Vitas-M small molecule compound
11-(1,3-benzodioxol-5-yl)-3,3-dimethyl-10-(phenylacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK868240
SMILES O=C1CC(C)(C)CC2=C1C(c1ccc3c(c1)OCO3)N(C(=O)Cc1ccccc1)c1c(N2)cccc1
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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 C30H28N2O4 MW 480.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N2O4/c1-30(2)16-22-28(24(33)17-30)29(20-12-13-25-26(15-20)36-18-35-25)32(23-11-7-6-10-21(23)31-22)27(34)14-19-8-4-3-5-9-19/h3-13,15,29,31H,14,16-18H2,1-2H3InChIKey
SUPPHKQZJDFGGJ-UHFFFAOYSA-NSynonyms
353471-76-811(13benzodioxol5yl)33dimethyl10(phenylacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(benzo(d)(13)dioxol5yl)33dimethyl10(2phenylacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
353471768
6(13benzodioxol5yl)99dimethyl5(2phenylacetyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)CC4=CC=CC=C4)C5=CC6=C(C=C5)OCO6)C(=O)C1)C
InChI=1SC30H28N2O4c130(2)162228(24(33)1730)29(2012132526(1520)36183525)32(2311761021(23)3122)27(34)14198435919h313152931H141618H212H3
MFCD01417202
ZINC000008995938
ZINC000008995939
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