Vitas-M small molecule compound

methyl 5-bromo-6-oxo-1-(pyridin-3-ylmethyl)-1,6-dihydropyridine-3-carboxylate

Catalog ID
STK530874
SMILES COC(=O)c1cn(Cc2cccnc2)c(=O)c(c1)Br

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C13H11BrN2O3 MW 323.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11BrN2O3/c1-19-13(18)10-5-11(14)12(17)16(8-10)7-9-3-2-4-15-6-9/h2-6,8H,7H2,1H3
InChIKey
MXHGRGVULPJGRE-UHFFFAOYSA-N
Synonyms

5BROMO6KETO1(3PYRIDYLMETHYL)NICOTINICACIDMETHYLESTER
5BROMO6OXO1(3PYRIDINYLMETHYL)3PYRIDINECARBOXYLICACIDMETHYLESTER
COC(=O)C1=CN(C(=O)C(=C1)Br)CC2=CN=CC=C2
InChI=1SC13H11BrN2O3c11913(18)10511(14)12(17)16(810)793241569h268H7H21H3
METHYL5BROMANYL6OXIDANYLIDENE1(PYRIDIN3YLMETHYL)PYRIDINE3CARBOXYLATE
methyl5bromo6oxo1(pyridin3ylmethyl)16dihydropyridine3carboxylate
METHYL5BROMO6OXO1(PYRIDIN3YLMETHYL)PYRIDINE3CARBOXYLATE
MFCD02240443
ZINC000000507601
ZINC00507601
ZINC507601

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.