Vitas-M small molecule compound

1-[11-(3,5-dichloro-2-methoxyphenyl)-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
STL044768
SMILES COc1c(Cl)cc(cc1C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C(C)C)cccc2)(C)C)Cl

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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 C26H28Cl2N2O3 MW 487.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28Cl2N2O3/c1-14(2)25(32)30-20-9-7-6-8-18(20)29-19-12-26(3,4)13-21(31)22(19)23(30)16-10-15(27)11-17(28)24(16)33-5/h6-11,14,23,31H,12-13H2,1-5H3
InChIKey
KYEAEKQVGDCJTJ-UHFFFAOYSA-N
Synonyms

1(11(35dichloro2methoxyphenyl)1hydroxy33dimethyl23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)2methylpropan1one
MFCD03812995
ZINC000102880960
ZINC000102880963

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Available files

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