Vitas-M small molecule compound

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

Catalog ID
STK077413
SMILES COc1cccc(c1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C1CC1)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 C26H28N2O3 MW 416.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O3/c1-26(2)14-20-23(22(29)15-26)24(17-7-6-8-18(13-17)31-3)28(25(30)16-11-12-16)21-10-5-4-9-19(21)27-20/h4-10,13,16,24,29H,11-12,14-15H2,1-3H3
InChIKey
LVTLUGDKDITAIH-UHFFFAOYSA-N
Synonyms
733801-49-5
733801495
COc1cccc(c1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C1CC1)cccc2)(C)C
cyclopropyl(1hydroxy11(3methoxyphenyl)33dimethyl23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)methanone
MFCD03194628
STK077413
ZINC000101478014
ZINC000101478015

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Available files

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