Vitas-M small molecule compound
11-(5-bromo-2-hydroxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK869767
SMILES Brc1ccc(c(c1)C1Nc2ccccc2NC2=C1C(=O)CC(C2)(C)C)O
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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 C21H21BrN2O2 MW 413.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrN2O2/c1-21(2)10-16-19(18(26)11-21)20(13-9-12(22)7-8-17(13)25)24-15-6-4-3-5-14(15)23-16/h3-9,20,23-25H,10-11H2,1-2H3InChIKey
FYUBFNFERQTIQD-UHFFFAOYSA-NSynonyms
338426-69-011(5bromo2hydroxyphenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
338426690
6(5bromo2hydroxyphenyl)99dimethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(NC3=CC=CC=C3N2)C4=C(C=CC(=C4)Br)O)C(=O)C1)C
InChI=1SC21H21BrN2O2c121(2)101619(18(26)1121)20(13912(22)7817(13)25)2415643514(15)2316h39202325H1011H212H3
MFCD01831013
ZINC000005092282
ZINC000005092283
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