Vitas-M small molecule compound
4-{4-[(2-chlorobenzyl)oxy]phenyl}-3-methyl-1-(7H-purin-6-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Catalog ID
STL494661
SMILES O=C1CC(c2ccc(cc2)OCc2ccccc2Cl)c2c(N1)n(nc2C)c1ncnc2c1[nH]cn2
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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 C25H20ClN7O2 MW 485.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClN7O2/c1-14-21-18(15-6-8-17(9-7-15)35-11-16-4-2-3-5-19(16)26)10-20(34)31-24(21)33(32-14)25-22-23(28-12-27-22)29-13-30-25/h2-9,12-13,18H,10-11H2,1H3,(H,31,34)(H,27,28,29,30)InChIKey
LGRACIGMXFSTML-UHFFFAOYSA-NSynonyms
4(4((2chlorobenzyl)oxy)phenyl)3methyl1(7Hpurin6yl)1457tetrahydro6Hpyrazolo(34b)pyridin6one
4(4((2chlorobenzyl)oxy)phenyl)3methyl1(9Hpurin6yl)45dihydro1Hpyrazolo(34b)pyridin6(7H)one
MFCD30716544
O=C1CC(c2ccc(cc2)OCc2ccccc2Cl)c2c(N1)n(nc2C)c1ncnc2c1(nH)cn2
O=C1CC(c2ccc(cc2)OCc2ccccc2Cl)c2c(N1)n(nc2C)c1ncnc2c1nc(nH)2
ZINC000524734228
ZINC000524734229
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