Vitas-M small molecule compound
10-hexanoyl-3-(4-methylphenyl)-11-[4-(propan-2-yloxy)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK548140
SMILES CCCCCC(=O)N1C(c2ccc(cc2)OC(C)C)C2=C(Nc3c1cccc3)CC(CC2=O)c1ccc(cc1)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 C35H40N2O3 MW 536.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H40N2O3/c1-5-6-7-12-33(39)37-31-11-9-8-10-29(31)36-30-21-27(25-15-13-24(4)14-16-25)22-32(38)34(30)35(37)26-17-19-28(20-18-26)40-23(2)3/h8-11,13-20,23,27,35-36H,5-7,12,21-22H2,1-4H3InChIKey
UGAONEQDCRZECK-UHFFFAOYSA-NSynonyms
496796-64-610hexanoyl11(4isopropoxyphenyl)3(ptolyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
10hexanoyl3(4methylphenyl)11(4(propan2yloxy)phenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
496796646
5hexanoyl9(4methylphenyl)6(4propan2yloxyphenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCCCCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)C)NC4=CC=CC=C41)C5=CC=C(C=C5)OC(C)C
InChI=1SC35H40N2O3c15671233(39)373111981029(31)36302127(25151324(4)141625)2232(38)34(30)35(37)26171928(201826)4023(2)3h811132023273536H57122122H214H3
MFCD03298866
ZINC000009379878
ZINC000009679528
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