Vitas-M small molecule compound
11-(1,3-benzodioxol-5-yl)-3-(4-fluorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK407823
SMILES Fc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccc2c(c1)OCO2
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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 C26H21FN2O3 MW 428.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21FN2O3/c27-18-8-5-15(6-9-18)17-11-21-25(22(30)12-17)26(29-20-4-2-1-3-19(20)28-21)16-7-10-23-24(13-16)32-14-31-23/h1-10,13,17,26,28-29H,11-12,14H2InChIKey
JEOYTJHJEPVVGE-UHFFFAOYSA-NSynonyms
11(13benzodioxol5yl)3(4fluorophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(13benzodioxol5yl)9(4fluorophenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
C1C(CC(=O)C2=C1NC3=CC=CC=C3NC2C4=CC5=C(C=C4)OCO5)C6=CC=C(C=C6)F
InChI=1SC26H21FN2O3c27188515(6918)17112125(22(30)1217)26(2920421319(20)2821)167102324(1316)32143123h1101317262829H111214H2
MFCD07358944
ZINC000016447541
ZINC000016447546
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