Vitas-M small molecule compound

11-(3-bromo-4,5-dimethoxyphenyl)-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK080261
SMILES COc1c(Br)cc(cc1OC)C1Nc2ccccc2NC2=C1C(=O)CC(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 C27H25BrN2O3 MW 505.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25BrN2O3/c1-32-24-15-18(12-19(28)27(24)33-2)26-25-22(29-20-10-6-7-11-21(20)30-26)13-17(14-23(25)31)16-8-4-3-5-9-16/h3-12,15,17,26,29-30H,13-14H2,1-2H3
InChIKey
FSFGCZHCPLVEAS-UHFFFAOYSA-N
Synonyms

11(3bromo45dimethoxyphenyl)3phenyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(3BROMO45DIMETHOXYPHENYL)3PHENYL234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
6(3bromo45dimethoxyphenyl)9phenyl56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=C(C(=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC5=CC=CC=C5N2)Br)OC
COc1c(Br)cc(cc1OC)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccccc1
InChI=1SC27H25BrN2O3c132241518(1219(28)27(24)332)262522(292010671121(20)3026)1317(1423(25)31)168435916h3121517262930H1314H212H3
MFCD02104495
STK080261
ZINC000000710629
ZINC000000710632

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Available files

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