Vitas-M small molecule compound

N-(2,6-dimethylphenyl)-2-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)-3-phenylpropanamide

Catalog ID
STK258389
SMILES O=C(C(N1C(=O)C2C(C1=O)C1CC2CC1)Cc1ccccc1)Nc1c(C)cccc1C

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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 C26H28N2O3 MW 416.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O3/c1-15-7-6-8-16(2)23(15)27-24(29)20(13-17-9-4-3-5-10-17)28-25(30)21-18-11-12-19(14-18)22(21)26(28)31/h3-10,18-22H,11-14H2,1-2H3,(H,27,29)
InChIKey
FFOCRYAYFPOZSH-UHFFFAOYSA-N
Synonyms

CC1=C(C(=CC=C1)C)NC(=O)C(CC2=CC=CC=C2)N3C(=O)C4C5CCC(C5)C4C3=O
InChI=1SC26H28N2O3c11576816(2)23(15)2724(29)20(131794351017)2825(30)2118111219(1418)22(21)26(28)31h3101822H1114H212H3(H2729)
MFCD03650736
N(26DIMETHYLPHENYL)2(13DIOXOOCTAHYDRO2H47METHANOISOINDOL2YL)3PHENYLPROPANAMIDE
ZINC000101465471
ZINC000239038977

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Available files

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