Vitas-M small molecule compound

2-(4-methylphenyl)-5-phenylhexahydro-1H-isoindole-1,3(2H)-dione

Catalog ID
STK258111
SMILES Cc1ccc(cc1)N1C(=O)C2C(C1=O)CCC(C2)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 C21H21NO2 MW 319.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO2/c1-14-7-10-17(11-8-14)22-20(23)18-12-9-16(13-19(18)21(22)24)15-5-3-2-4-6-15/h2-8,10-11,16,18-19H,9,12-13H2,1H3
InChIKey
NNTFSKVPDHOQGX-UHFFFAOYSA-N
Synonyms

2(4methylphenyl)5phenyl3a45677ahexahydroisoindole13dione
2(4methylphenyl)5phenylhexahydro1Hisoindole13(2H)dione
CC1=CC=C(C=C1)N2C(=O)C3CCC(CC3C2=O)C4=CC=CC=C4
InChI=1SC21H21NO2c11471017(11814)2220(23)1812916(1319(18)21(22)24)155324615h281011161819H91213H21H3
MFCD03901225
ZINC000084923914
ZINC000239165138

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Available files

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