Category: Pyrazines

Let¡¯s face it, organic chemistry can seem difficult to learn, Recommanded Product: 22047-25-2, Especially from a beginner¡¯s point of view. Like 22047-25-2, Name is Acetylpyrazine, molecular formula is Pyrazines, belongs to Pyrazines compound. In a document, author is Glisic, Biljana D., introducing its new discovery.

Mononuclear gold(iii) complexes with diazanaphthalenes: the influence of the position of nitrogen atoms in the aromatic rings on the complex crystalline properties

A series of mononuclear gold(iii) complexes of the general formula [AuCl3(diazanaphthalene)], where diazanaphthalene is quinazoline (qz, 1), phthalazine (phtz, 2), 1,5-naphthyridine (1,5-naph, 3), 1,6-naphthyridine (1,6-naph, 4) or 1,8-naphthyridine (1,8-naph, 5), were prepared and fully characterized. The complexes 1-5 consist of discrete monomeric species with the Au(iii) cation in a square planar coordination geometry surrounded by three chloride anions and one diazanaphthalene ligand. Crystallographic studies indicate the presence of an extended 4 + 1 or 4 + 2 geometry around the square planar [AuCl3(diazanaphthalene)] center due to AuMIDLINE HORIZONTAL ELLIPSISCl and AuMIDLINE HORIZONTAL ELLIPSISN interactions. The crystal structures of these complexes are controlled by a variety of intermolecular interactions that utilize the amphiphilic properties of the coordinated chloride anions and involve C-H groups, pi-electrons, and an uncoordinated nitrogen atom of the diazanaphthalene ligand. The usual offset pi-stacking between the N-heteroaromatic ligands appears to be completely hindered between the 1,5-naph fragments and significantly weakened between the 1,6-naph and 1,8-naph in their respective complexes 3, 4 and 5, for which the average molecular polarizability (alpha) values are the lowest in the series. It is remarkable that the [AuCl3(benzodiazine)] complexes 1 and 2 form centrosymmetric crystals, but the [AuCl3(naphthyridine)] complexes 3-5 assemble into non-centrosymmetric aggregates, making them potential alternatives to the previously studied systems for application in various fields by taking advantage of their polarity.

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A catalyst don’t appear in the overall stoichiometry of the reaction it catalyzes, but it must appear in at least one of the elementary reactions in the mechanism for the catalyzed reaction. 123-32-0, Name is 2,5-Dimethylpyrazine, molecular formula is C6H8N2. In an article, author is Carvalho, Edinilton Muniz,once mentioned of 123-32-0, Formula: C6H8N2.

Pentacyanoferrate(II) complex of pyridine-4-and pyrazine-2-hydroxamic acid as source of HNO: investigation of anti-tubercular and vasodilation activities

A pharmacophore design approach, based on the coordination chemistry of an intimate molecular hybrid of active metabolites of pro-drugs, known to release active species upon enzymatic oxidative activation, is devised. This is exemplified by combining two anti-mycobacterial drugs: pyrazinamide (first line) and delamanid (third line) whose active metabolites are pyrazinoic acid (PyzCOOH) and likely nitroxyl (HNO (or NO.)), respectively. Aiming to generate those active species, a hybrid compound was envisaged by coordination of pyrazine-2-hydroxamic acid (PyzCONHOH) with a Na-3[Fe-II(CN)(5)] moiety. The corresponding pentacyanoferrate(II) complex Na-4[Fe-II(CN)(5)(PyzCONHO(-))] was synthesized and characterized by several spectroscopic techniques, cyclic voltammetry, and DFT calculations. Chemical oxidation of this complex with H(2)O(2)was shown to induce the release of the metabolite PyzCOOH, without the need of theMycobacterium tuberculosis(Mtb) pyrazinamidase enzyme (PncA). Control experiments show that both H2O2- and N-coordinated pyrazine Fe(II)species are required, ruling out a direct hydrolysis of the hydroxamic acid or an alternative oxidative route through chelation of a metal center by a hydroxamic group. The release of HNO was observed using EPR spectroscopy in the presence of a spin trapping agent. The devised iron metal complex of pyrazine-2-hydroxamic acid was found inactive against an actively growing/non-resistantMtbstrain; however, it showed a strong dose-dependent and reversible vasodilatory activity with mostly lesser toxic effects than the reference drug sodium nitroprussiate, unveiling thus a potential indication for acute or chronic cardiovascular pathology. This is a priori a further indirect evidence of HNO release from this metal complex, standing as a possible pharmacophore model for an alternative vasodilator drug.

Interested yet? Keep reading other articles of 123-32-0, you can contact me at any time and look forward to more communication. Formula: C6H8N2.

In an article, author is Karaaslan, Cigdem, once mentioned the application of 22047-25-2, COA of Formula: C6H6N2O, Name is Acetylpyrazine, molecular formula is C6H6N2O, molecular weight is 122.1246, MDL number is MFCD00006134, category is Pyrazines. Now introduce a scientific discovery about this category.

Regioselective N-alkylation of some imidazole-containing heterocycles and their in vitro anticancer evaluation

Imidazole-containing heterocycles: Imidazopyridines, imidazopyrimidines and imidazopyra-zines can exist more tautomeric forms than benzimidazoles. Their regioselectivities were determined for N-alkylations with 4-fluorobenzyl bromide under basic conditions (K2CO3) in DMF. We observed that, regioisomers were mainly formed as a mixture in this reaction and N-benzylation occurs at a higher ratio on six membered heterocycles. Their structural assignments were made with the use of two-dimensional H-1-H-1 NOE (nuclear overhauser effect spectroscopy, NOESY). Complementary structural informationwas provided by 2D-HMBC spectra of the compounds. Synthesized compounds were tested for in vitro cytotoxic activities against Human colon cancer cell line (HCT-116) and leukemia cell lines (K562 and HL-60) by MTT test. Among them, imidazopyridine analogue 10, bearing bromine atom at the C-6 position of the pyridine moiety, gave the lowest IC50 value with 6-7 mu g/mL against all three cancer cell lines. (C) 2020 Elsevier B.V. All rights reserved.

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The reaction rate of a catalyzed reaction is faster than the reaction rate of the uncatalyzed reaction at the same temperature. 22047-25-2, Name is Acetylpyrazine, SMILES is C1=C(N=CC=N1)C(=O)C, in an article , author is Pan, Lei, once mentioned of 22047-25-2, Recommanded Product: Acetylpyrazine.

Oxidative Ring-Opening of 1H-Pyrazol-5-amines and Its Application in Constructing Pyrazolo-Pyrrolo-Pyrazine Scaffolds by Domino Cyclization

Herein, an oxidative ring-opening of 1H-pyrazol-5-amines to form 3-diazenylacrylonitrile derivatives under mild and transition-metal-free conditions is described. In addition, the nucleophilic addition of deprotonated 1H-pyrrole-2-carbaldehydes to the vinyl moiety of the yielded 3-diazenylacrylonitriles could trigger domino cyclization to afford the 3H-pyrazolo[3,4-e]pyrrolo[1,2-a]pyrazine derivatives. Computational studies suggest that the oxidation of 1H-pyrazol-5-amines in the presence of PhIO is through the formation of a hydroxylamine intermediate followed by elimination of H2O to result in the ring-opening product. The detailed domino cyclization pathway leading to the pyrazolo-pyrrolo-pyrazine scaffolds is revealed.

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In an article, author is Xu, Chanchan, once mentioned the application of 14508-49-7, Product Details of 14508-49-7, Name is 2-Chloropyrazine, molecular formula is C4H3ClN2, molecular weight is 114.53, MDL number is MFCD00006124, category is Pyrazines. Now introduce a scientific discovery about this category.

Synthesis, structure and photoluminescence properties of three copper(i) iodide based inorganic-organic hybrid structures with pyrazine derivatives

By using pyrazine derivatives, three different types of copper(i) iodide based inorganic-organic hybrid structures, 1D-CuI(2-mo-pz) (1, 2-mo-pz = 2-methoxy-pyrazine), 2D-CuI(2,3-dm-pz)(0.5)(2, 2,3-dm-pz = 2,3-dimethyl-pyrazine), and 2D-Cu2I2(2,5-dm-pz)(2)(3, 2,5-dm-pz = 2,5-dimethyl-pyrazine), have been obtained by using a slow-diffusion method. Single crystal and powder X-ray diffraction analyses reveal that these hybrid structures are a one-dimensional (1D) staircase chain based structure, two-dimensional (2D) staircase-chain based structure, and 2D rhomboid dimer based structure, respectively. All of the three compounds show photoluminescence, with the internal quantum yield (IQY) as high as 88.2% for1. This work provides evidence that for this type of hybrid materials, the structure of the inorganic module could be determined by the selection of the organic ligands and that the substituted group on the organic ligands can influence the luminescence efficiency of the hybrid structures.

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Chemistry is the experimental and theoretical study of materials on their properties at both the macroscopic and microscopic levels. 22047-25-2, Name is Acetylpyrazine, molecular formula is C6H6N2O. In an article, author is Khavasi, Hamid Reza,once mentioned of 22047-25-2, Safety of Acetylpyrazine.

Complementary Features of Inorganic (M-X) and Organic (C-X ‘) Halogens in C-X ‘center dot center dot center dot X-M Halogen Bonds: A Study Based on Structure, Energy, and Topological Electron Density

A family of 10 compounds, each containing a MX2-pyrazine carboxylate complex anion and a protonated halo- (X’-) amino pyridine cation (MX2 = ZnCl2, ZnBr2, ZnI2, HgBr2, and HgI2; X’ = Cl, Br, I), are presented; a suitable system for pursuing C-X’center dot center dot center dot X-M halogen bonding (XB). The influence of halogen manipulation, metal ion and coordination variation on the nature and strength of C-X’center dot center dot center dot X-M interactions was discussed in terms of geometrical parameters, binding energies and charge density analysis with emphasis on the Laplacian of the electron density, del(2)rho. Interplay of XBs with other noncovalent interactions, mainly N-H center dot center dot center dot XM and N-py-H+center dot center dot center dot O- bonds, in supramolecular assemblies, were also investigated. The C-X’center dot center dot center dot X-M and N-H center dot center dot center dot X-M bonds have rationally been modified in strength upon changing the halogens involved, leading to systematic variations in the crystal packing.

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Catalysts are substances that increase the reaction rate of a chemical reaction without being consumed in the process. 2847-30-5, Name is 2-Methoxy-3-methylpyrazine, SMILES is COC1=C(C)N=CC=N1, belongs to Pyrazines compound. In a document, author is Dagar, Anuradha, introduce the new discover, Recommanded Product: 2847-30-5.

A domino annulation approach to 3,4-diacylpyrrolo[1,2-a]pyrazines: decoration of pyrazine units

A new one-pot, sequential three-component access to 3,4-diacylpyrrolo[1,2-a]pyrazine was achieved from the reaction of an alpha-haloketone, azide, and N-substituted pyrrole-2-carboxaldehyde under mild reaction conditions, through which a polysubstitution pattern on the pyrazine moiety of the scaffold was realized. The formation of multiple bonds (one C-C and two C-N) was enabled by this domino process involving the in situ generation of alpha-iminoketones, intermolecular Mannich reaction, intramolecular imine formation, and aromatization. Construction of the relevant 3,4-diacylpyrazino[1,2-a]indole and further expansion of this chemical space via synthetic elaboration of the resulting products were demonstrated as well. Preliminary biological screening of the synthesized derivatives against oral adenosquamous carcinoma cells (CAL-27) and triple negative human breast cancer cells (MDA-MB-231) led us to identify a potent hit compound (7o) having similar to 3 times stronger in vitro anticancer activity than that of the anticancer agent, capecitabine.

The proportionality constant is the rate constant for the particular unimolecular reaction. the reaction rate is directly proportional to the concentration of the reactant. I hope my blog about 2847-30-5 is helpful to your research. Recommanded Product: 2847-30-5.

The reaction rate of a catalyzed reaction is faster than the reaction rate of the uncatalyzed reaction at the same temperature. 33332-25-1, Name is Methyl 5-chloropyrazine-2-carboxylate, SMILES is ClC1=CN=C(C=N1)C(=O)OC, in an article , author is Layek, Ujjwal, once mentioned of 33332-25-1, Recommanded Product: Methyl 5-chloropyrazine-2-carboxylate.

Floral traits and chemical cues associated with rock bee (Apis dorsata Fabricius) for the host selection in West Bengal, India

In the present work, bee foraging plants were determined by palynological analysis of colony stored samples (honey and pollen) of Apis dorsata collected from southern West Bengal, India. Then flowering phenology and pollen morphologies were described to evaluate the forage preference of the bee species. In addition, chemical cues were analysed using gas chromatography-mass spectrometry (GC-MS). Foraging strategy of the bee species was profitable in that almost all the bee-visited plants were utilised for both nectar and pollen sources. The bee species became generalist visitor of several plants having diverse life form, flower characters and pollen morphologies. However, most of the bee-visited plants were of trees with synchronous type of flowering. Most plants had small-sized, yellow, cream and white coloured flowers and pollen was openly presented. We did not find any patterns in the morphological traits of bee collected pollen, though the pollen types were predominantly of medium sized with trizonocolporate apertural pattern and reticulate surface ornamentation. Floral volatile organic compounds (VOCs) of bee visited plants were also diversified. Compounds frequently found in the floral VOC bouquets were amphetamine-3-methyl; butane, 2-cyclopropyl; 2,3-butanediol; cyclohexan, 1-methyl-5-(1-methylethyl); d-limonene; methyl (2E)-2-methoxy-2-butenoate; phenol, 4-[2-(methylamino)ethyl]; phthalic acid, di(2-propylpentyl)ester; propanamide, N-(aminocarbonyl) and pyrrolo[1,2-a]pyrazine-1,4-dione, hexahydro-3-(2-methylpropyl). In conclusion, floral traits and chemical cues of plants influence the host selection specificity (to collect floral rewards) of the rock bees.

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Application of 1049026-49-4, Enzymes are biological catalysts that produce large increases in reaction rates and tend to be specific for certain reactants and products. 1049026-49-4, Name is 2-Bromo-5-(methylthio)pyrazine, SMILES is CSC1=CN=C(Br)C=N1, belongs to Pyrazines compound. In a article, author is Song, Xuebo, introduce new discover of the category.

Untargeted and targeted metabolomics strategy for the classification of strong aroma-type baijiu (liquor) according to geographical origin using comprehensive two-dimensional gas chromatography-time-of-flight mass spectrometry

A metabolomics strategy was developed to differentiate strong aroma-type baijiu (SAB) (distilled liquor) from the Sichuan basin (SCB) and Yangtze-Huaihe River Basin (YHRB) through liquid-liquid extraction coupled with GCxGC-TOFMS. PCA effectively separated the samples from these two regions. The PLS-DA training model was excellent, with explained variation and predictive capability values of 0.988 and 0.982, respectively. As a result, the model demonstrated its ability to perfectly differentiate all the unknown SAB samples. Twenty-nine potential markers were located by variable importance in projection values, and twenty-four of them were identified and quantitated. Discrimination ability is closely correlated to the characteristic flavor compounds, such as acid, esters, furans, alcohols, sulfides and pyrazine. Most of the marker compounds were less abundant in the SCB samples than in the YHRB samples. The quantitated markers were further processed using hierarchical cluster analysis for targeted analysis, indicating that the markers had great discrimination power to differentiate the SAB samples.

Application of 1049026-49-4, The reactant in an enzyme-catalyzed reaction is called a substrate. Enzyme inhibitors cause a decrease in the reaction rate of an enzyme-catalyzed reaction.I hope my blog about 1049026-49-4 is helpful to your research.

Catalysts are substances that increase the reaction rate of a chemical reaction without being consumed in the process. 14508-49-7, Name is 2-Chloropyrazine, SMILES is ClC1=CN=CC=N1, belongs to Pyrazines compound. In a document, author is Miyamoto, Masaya, introduce the new discover, Formula: C4H3ClN2.

Surface-enhanced Raman scattering of M-2-pyrazine-M-2 (M = Cu, Ag, Au): Analysis by natural perturbation orbitals and density functional theory functional dependence

Here, we propose a new method to analyze various electronic properties of molecules based on natural perturbation orbitals (NPOs). We applied the proposed method to chemical enhancement of the surface-enhanced Raman scattering (SERS) intensity of M-2-pyrazine-M-2 (M = Cu, Ag, Au) complexes. The SERS intensity can be effectively decomposed into the contributions of four NPO pairs (1 sigma-1 sigma*, 2 sigma-2 sigma*, 1 pi-1 pi*, and 2 pi-2 pi*), so NPO analysis makes the SERS intensity much easier to understand than by conventional canonical molecular orbitals. Moreover, we analyzed the dependence of the density functional theory functional on the SERS intensity. For the Ag-2-pyrazine-Ag-2 complex, the BP86 functional overestimates the Raman intensity by about 23 times compared with coupled-cluster singles and doubles level of theory, while the CAM-B3LYP functional gives moderately accurate values. This overestimation arises from the inaccuracy of the energy derivative along the normal vibrational mode.

The proportionality constant is the rate constant for the particular unimolecular reaction. the reaction rate is directly proportional to the concentration of the reactant. I hope my blog about 14508-49-7 is helpful to your research. Formula: C4H3ClN2.