Vitas-M small molecule compound
7-(phenylcarbonyl)-11-(2,3,4-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK040026
SMILES COc1c(ccc(c1OC)OC)C1Nc2ccc(cc2NC2=C1C(=O)CCC2)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 C29H28N2O5 MW 484.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O5/c1-34-24-15-13-19(28(35-2)29(24)36-3)26-25-21(10-7-11-23(25)32)30-22-16-18(12-14-20(22)31-26)27(33)17-8-5-4-6-9-17/h4-6,8-9,12-16,26,30-31H,7,10-11H2,1-3H3InChIKey
QFERXTTZTIKPGK-UHFFFAOYSA-NSynonyms
2benzoyl6(234trimethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
7(phenylcarbonyl)11(234trimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
COC1=C(C(=C(C=C1)C2C3=C(CCCC3=O)NC4=C(N2)C=CC(=C4)C(=O)C5=CC=CC=C5)OC)OC
COc1c(ccc(c1OC)OC)C1Nc2ccc(cc2NC2=C1C(=O)CCC2)C(=O)c1ccccc1
InChI=1SC29H28N2O5c13424151319(28(352)29(24)363)262521(1071123(25)32)30221618(121420(22)3126)27(33)178546917h46891216263031H71011H213H3
MFCD05031088
STK040026
ZINC000009246762
ZINC000009246763
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