Vitas-M small molecule compound

10-[(4-chlorophenyl)acetyl]-11-(2-fluorophenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK977125
SMILES Clc1ccc(cc1)CC(=O)N1c2ccccc2NC2=C(C1c1ccccc1F)C(=O)CC(C2)(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 C29H26ClFN2O2 MW 488.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26ClFN2O2/c1-29(2)16-23-27(25(34)17-29)28(20-7-3-4-8-21(20)31)33(24-10-6-5-9-22(24)32-23)26(35)15-18-11-13-19(30)14-12-18/h3-14,28,32H,15-17H2,1-2H3
InChIKey
UPYGBTBNPWXBAV-UHFFFAOYSA-N
Synonyms
292064-55-2
10((4chlorophenyl)acetyl)11(2fluorophenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
10(2(4chlorophenyl)acetyl)11(2fluorophenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
292064552
5(2(4chlorophenyl)acetyl)6(2fluorophenyl)99dimethyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)CC4=CC=C(C=C4)Cl)C5=CC=CC=C5F)C(=O)C1)C
InChI=1SC29H26ClFN2O2c129(2)162327(25(34)1729)28(20734821(20)31)33(241065922(24)3223)26(35)1518111319(30)141218h3142832H1517H212H3
MFCD01450219
ZINC000016946636
ZINC000016946639

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Available files

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