Vitas-M small molecule compound

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

Catalog ID
STL039337
SMILES Clc1ccc(c(c1)Cl)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C(C)C)cccc2)(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 C25H26Cl2N2O2 MW 457.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26Cl2N2O2/c1-14(2)24(31)29-20-8-6-5-7-18(20)28-19-12-25(3,4)13-21(30)22(19)23(29)16-10-9-15(26)11-17(16)27/h5-11,14,23,30H,12-13H2,1-4H3
InChIKey
SQJJJFGXEDMEPJ-UHFFFAOYSA-N
Synonyms

1(11(24dichlorophenyl)1hydroxy33dimethyl23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)2methylpropan1one
MFCD03800419
ZINC000102863897
ZINC000102863900

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Available files

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