Vitas-M small molecule compound
11-(2,3-dihydroxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK016698
SMILES O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cccc1)c1cccc(c1O)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 C21H22N2O3 MW 350.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3/c1-21(2)10-15-18(17(25)11-21)19(12-6-5-9-16(24)20(12)26)23-14-8-4-3-7-13(14)22-15/h3-9,19,22-24,26H,10-11H2,1-2H3InChIKey
GJQHXKXRJAGUTH-UHFFFAOYSA-NSynonyms
364608-99-111(23dihydroxyphenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
364608991
6(23dihydroxyphenyl)99dimethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(NC3=CC=CC=C3N2)C4=C(C(=CC=C4)O)O)C(=O)C1)C
InChI=1SC21H22N2O3c121(2)101518(17(25)1121)19(1265916(24)20(12)26)2314843713(14)2215h3919222426H1011H212H3
MFCD01922839
O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cccc1)c1cccc(c1O)O
STK016698
ZINC000018276441
ZINC000018276442
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