Vitas-M small molecule compound

3,3-dimethyl-10-(phenylcarbonyl)-11-(3-propoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK130338
SMILES CCCOc1cccc(c1)C1C2=C(Nc3c(N1C(=O)c1ccccc1)cccc3)CC(CC2=O)(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/h5-16,18,29,32H,4,17,19-20H2,1-3H3
InChIKey
HTXAMRPXBBFIEZ-UHFFFAOYSA-N
Synonyms
371129-51-0
10benzoyl33dimethyl11(3propoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
33dimethyl10(phenylcarbonyl)11(3propoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
371129510
5benzoyl99dimethyl6(3propoxyphenyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCCOC1=CC=CC(=C1)C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2C(=O)C5=CC=CC=C5
InChI=1SC31H32N2O3c1417362314101322(1823)292825(1931(23)2027(28)34)322415891626(24)33(29)30(35)21116571221h516182932H4171920H213H3
MFCD01921795
ZINC000009371067
ZINC000009371069

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Available files

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