Vitas-M small molecule compound

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

Catalog ID
STL155907
SMILES COc1cc(OC)ccc1C1CC(=Nc2c1n(cc2C(=O)O)c1cc(F)cc(c1)F)O

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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 C22H18F2N2O5 MW 428.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18F2N2O5/c1-30-14-3-4-15(18(8-14)31-2)16-9-19(27)25-20-17(22(28)29)10-26(21(16)20)13-6-11(23)5-12(24)7-13/h3-8,10,16H,9H2,1-2H3,(H,25,27)(H,28,29)
InChIKey
XWSDPWBSRAFJCX-UHFFFAOYSA-N
Synonyms
1282100-88-2
1(35difluorophenyl)7(24dimethoxyphenyl)5hydroxy67dihydro1Hpyrrolo(32b)pyridine3carboxylicacid
1(35difluorophenyl)7(24dimethoxyphenyl)5oxo67dihydro4Hpyrrolo(32b)pyridine3carboxylicacid
1282100882
COC1=CC(=C(C=C1)C2CC(=O)NC3=C2N(C=C3C(=O)O)C4=CC(=CC(=C4)F)F)OC
InChI=1SC22H18F2N2O5c130143415(18(814)312)16919(27)252017(22(28)29)1026(21(16)20)13611(23)512(24)713h381016H9H212H3(H2527)(H2829)
MFCD20757483
ZINC000061720532
ZINC000061720533

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Available files

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