Vitas-M small molecule compound
4-{6-[(3-chloro-4-fluorophenyl)amino]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzene-1,2-diol
Catalog ID
STK548116
SMILES Cc1nn(c2c1C(c1ccc(c(c1)O)O)n1c(=N2)c(Nc2ccc(c(c2)Cl)F)nc2c1cccc2)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 C31H22ClFN6O2 MW 565.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H22ClFN6O2/c1-17-27-28(18-11-14-25(40)26(41)15-18)38-24-10-6-5-9-23(24)35-29(34-19-12-13-22(33)21(32)16-19)31(38)36-30(27)39(37-17)20-7-3-2-4-8-20/h2-16,28,40-41H,1H3,(H,34,35)InChIKey
QCAYEADCVPDVNQ-UHFFFAOYSA-NSynonyms
4(6((3chloro4fluorophenyl)amino)10methyl8phenyl811dihydropyrazolo(3445)pyrimido(12a)quinoxalin11yl)benzene12diol
CC1=NN(C2=C1C(N3C4=CC=CC=C4N=C(C3=N2)NC5=CC(=C(C=C5)F)Cl)C6=CC(=C(C=C6)O)O)C7=CC=CC=C7
InChI=1SC31H22ClFN6O2c1172728(18111425(40)26(41)1518)38241065923(24)3529(3419121322(33)21(32)1619)31(38)3630(27)39(3717)207324820h216284041H1H3(H3435)
MFCD03667935
ZINC000001897638
ZINC000001897639
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