Vitas-M small molecule compound

methyl 4-({[4-(1,3-dioxo-5-phenyloctahydro-2H-4,7-methanoisoindol-2-yl)phenyl]carbonyl}amino)benzoate

Catalog ID
STK264484
SMILES COC(=O)c1ccc(cc1)NC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2C(C1)c1ccccc1

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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 C30H26N2O5 MW 494.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N2O5/c1-37-30(36)19-7-11-21(12-8-19)31-27(33)18-9-13-22(14-10-18)32-28(34)25-20-15-23(17-5-3-2-4-6-17)24(16-20)26(25)29(32)35/h2-14,20,23-26H,15-16H2,1H3,(H,31,33)
InChIKey
QWNRRDKDTGLMBY-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=O)C4C5CC(C4C3=O)C(C5)C6=CC=CC=C6
InChI=1SC30H26N2O5c13730(36)1971121(12819)3127(33)1891322(141018)3228(34)25201523(175324617)24(1620)26(25)29(32)35h214202326H1516H21H3(H3133)
methyl4(((4(13dioxo5phenyloctahydro2H47methanoisoindol2yl)phenyl)carbonyl)amino)benzoate
MFCD06194536
ZINC000100397259
ZINC000239402649

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Available files

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