Vitas-M small molecule compound
11-(4-methoxyphenyl)-3,3-dimethyl-7-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK094111
SMILES COc1ccc(cc1)C1Nc2ccc(cc2NC2=C1C(=O)CC(C2)(C)C)C(=O)c1ccccc1
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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 C29H28N2O3 MW 452.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O3/c1-29(2)16-24-26(25(32)17-29)27(18-9-12-21(34-3)13-10-18)31-22-14-11-20(15-23(22)30-24)28(33)19-7-5-4-6-8-19/h4-15,27,30-31H,16-17H2,1-3H3InChIKey
CSPMJCBJPVAGFP-UHFFFAOYSA-NSynonyms
11(4methoxyphenyl)33dimethyl7(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
2benzoyl6(4methoxyphenyl)99dimethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(NC3=C(N2)C=C(C=C3)C(=O)C4=CC=CC=C4)C5=CC=C(C=C5)OC)C(=O)C1)C
COc1ccc(cc1)C1Nc2ccc(cc2NC2=C1C(=O)CC(C2)(C)C)C(=O)c1ccccc1
InChI=1SC29H28N2O3c129(2)162426(25(32)1729)27(1891221(343)131018)3122141120(1523(22)3024)28(33)197546819h415273031H1617H213H3
MFCD01828937
STK094111
ZINC000000671869
ZINC000000671871
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