Vitas-M small molecule compound

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

Catalog ID
STL152641
SMILES COc1cc(OC)c(cc1C1CC(=Nc2c1n(cc2C(=O)O)c1cccc(c1)Cl)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 C23H21ClN2O6 MW 456.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN2O6/c1-30-17-10-19(32-3)18(31-2)8-14(17)15-9-20(27)25-21-16(23(28)29)11-26(22(15)21)13-6-4-5-12(24)7-13/h4-8,10-11,15H,9H2,1-3H3,(H,25,27)(H,28,29)
InChIKey
PCTHWSPNUSEYGZ-UHFFFAOYSA-N
Synonyms
1246046-14-9
1(3chlorophenyl)5hydroxy7(245trimethoxyphenyl)67dihydro1Hpyrrolo(32b)pyridine3carboxylicacid
1(3chlorophenyl)5oxo7(245trimethoxyphenyl)67dihydro4Hpyrrolo(32b)pyridine3carboxylicacid
1246046149
COC1=CC(=C(C=C1C2CC(=O)NC3=C2N(C=C3C(=O)O)C4=CC(=CC=C4)Cl)OC)OC
InChI=1SC23H21ClN2O6c130171019(323)18(312)814(17)15920(27)252116(23(28)29)1126(22(15)21)1364512(24)713h48101115H9H213H3(H2527)(H2829)
MFCD20756422
ZINC000049546410
ZINC000049546412

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Available files

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