Vitas-M small molecule compound

[1-hydroxy-3,3-dimethyl-11-(3-propoxyphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl](phenyl)methanone

Catalog ID
STL038588
SMILES CCCOc1cccc(c1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)c1ccccc1)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 C31H32N2O3 MW 480.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N2O3/c1-4-17-36-23-14-10-13-22(18-23)29-28-25(19-31(2,3)20-27(28)34)32-24-15-8-9-16-26(24)33(29)30(35)21-11-6-5-7-12-21/h5-16,18,29,34H,4,17,19-20H2,1-3H3
InChIKey
QPHKOJKUWWYELD-UHFFFAOYSA-N
Synonyms

(1hydroxy33dimethyl11(3propoxyphenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)(phenyl)methanone
MFCD03802544
ZINC000102860915
ZINC000102860919

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Available files

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