Vitas-M small molecule compound

1-[11-(3,4-dichlorophenyl)-1-hydroxy-3,3-dimethyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]pentan-1-one

Catalog ID
STL148172
SMILES CCCCC(=O)N1C(c2ccc(c(c2)Cl)Cl)C2=C(O)CC(CC2=Nc2c1cccc2)(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 C26H28Cl2N2O2 MW 471.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28Cl2N2O2/c1-4-5-10-23(32)30-21-9-7-6-8-19(21)29-20-14-26(2,3)15-22(31)24(20)25(30)16-11-12-17(27)18(28)13-16/h6-9,11-13,25,31H,4-5,10,14-15H2,1-3H3
InChIKey
IVQWSUZTHHNZCA-UHFFFAOYSA-N
Synonyms

1(11(34dichlorophenyl)1hydroxy33dimethyl23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)pentan1one
MFCD03802357
ZINC000102926456
ZINC000102926460

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Available files

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