Vitas-M small molecule compound

3-(4-tert-butylphenyl)-11-(4-fluorophenyl)-3,4,10,11-tetrahydro-2H-dibenzo[b,e][1,4]diazepin-1-ol

Catalog ID
STK072950
SMILES Fc1ccc(cc1)C1Nc2ccccc2N=C2C1=C(O)CC(C2)c1ccc(cc1)C(C)(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 C29H29FN2O MW 440.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29FN2O/c1-29(2,3)21-12-8-18(9-13-21)20-16-25-27(26(33)17-20)28(19-10-14-22(30)15-11-19)32-24-7-5-4-6-23(24)31-25/h4-15,20,28,32-33H,16-17H2,1-3H3
InChIKey
XEVKWAVTQJYFCZ-UHFFFAOYSA-N
Synonyms

3(4tertbutylphenyl)11(4fluorophenyl)341011tetrahydro2Hdibenzo(be)(14)diazepin1ol
Fc1ccc(cc1)C1Nc2ccccc2N=C2C1=C(O)CC(C2)c1ccc(cc1)C(C)(C)C
MFCD03032507
STK072950
ZINC000101472944
ZINC000101472950

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Available files

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