Vitas-M small molecule compound

11-(4-methoxyphenyl)-3,3-dimethyl-1-oxo-N-phenyl-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide

Catalog ID
STK513677
SMILES COc1ccc(cc1)C1C2=C(Nc3c(N1C(=O)Nc1ccccc1)cccc3)CC(CC2=O)(C)C

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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 C29H29N3O3 MW 467.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O3/c1-29(2)17-23-26(25(33)18-29)27(19-13-15-21(35-3)16-14-19)32(24-12-8-7-11-22(24)31-23)28(34)30-20-9-5-4-6-10-20/h4-16,27,31H,17-18H2,1-3H3,(H,30,34)
InChIKey
QMRUPTFKNCMELK-UHFFFAOYSA-N
Synonyms
11(4methoxyphenyl)33dimethyl1oxoNphenyl1234511hexahydro10Hdibenzo(be)(14)diazepine10carboxamide
6(4methoxyphenyl)99dimethyl7oxoNphenyl681011tetrahydrobenzo(b)(14)benzodiazepine5carboxamide
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)NC4=CC=CC=C4)C5=CC=C(C=C5)OC)C(=O)C1)C
Registry IDs
MFCD13370419
ZINC000015826225
ZINC000015826228

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Available files

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