Vitas-M small molecule compound

1-(2,5-dimethoxyphenyl)-5-hydroxy-7-(pyridin-4-yl)-6,7-dihydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid

Catalog ID
STL536230
SMILES COc1ccc(c(c1)n1cc(c2c1C(CC(=N2)O)c1ccncc1)C(=O)O)OC

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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 C21H19N3O5 MW 393.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O5/c1-28-13-3-4-17(29-2)16(9-13)24-11-15(21(26)27)19-20(24)14(10-18(25)23-19)12-5-7-22-8-6-12/h3-9,11,14H,10H2,1-2H3,(H,23,25)(H,26,27)
InChIKey
AMQCTKJRXOXRNY-UHFFFAOYSA-N
Synonyms
1224164-93-5
1(25dimethoxyphenyl)5hydroxy7(pyridin4yl)67dihydro1Hpyrrolo(32b)pyridine3carboxylicacid
1(25dimethoxyphenyl)5oxo7pyridin4yl67dihydro4~(H)pyrrolo(32b)pyridine3carboxylicacid
1224164935
51052168
InChI=1SC21H19N3O5c128133417(292)16(913)241115(21(26)27)1920(24)14(1018(25)2319)1257228612h391114H10H212H3(H2325)(H2627)
MFCD31754375
ZINC000049543285
ZINC000049543287

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Available files

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