Vitas-M small molecule compound
1-(5-chloro-2-methylphenyl)-5-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Catalog ID
STL031293
SMILES COc1ccc(cc1)N1CCN(CC1)C(=O)Cn1cnc2c(c1=O)cnn2c1cc(Cl)ccc1C
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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 C25H25ClN6O3 MW 492.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN6O3/c1-17-3-4-18(26)13-22(17)32-24-21(14-28-32)25(34)31(16-27-24)15-23(33)30-11-9-29(10-12-30)19-5-7-20(35-2)8-6-19/h3-8,13-14,16H,9-12,15H2,1-2H3InChIKey
JQMARZNEUNMSHA-UHFFFAOYSA-NSynonyms
1(5chloro2methylphenyl)5(2(4(4methoxyphenyl)piperazin1yl)2oxoethyl)15dihydro4Hpyrazolo(34d)pyrimidin4one
1(5chloro2methylphenyl)5(2(4(4methoxyphenyl)piperazin1yl)2oxoethyl)pyrazolo(34d)pyrimidin4one
CC1=C(C=C(C=C1)Cl)N2C3=C(C=N2)C(=O)N(C=N3)CC(=O)N4CCN(CC4)C5=CC=C(C=C5)OC
InChI=1SC25H25ClN6O3c1173418(26)1322(17)322421(142832)25(34)31(162724)1523(33)3011929(101230)195720(352)8619h38131416H91215H212H3
MFCD18191357
ZINC000067673633
ZINC67673633
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