Vitas-M small molecule compound
7-(2,4-dichlorobenzyl)-8-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK594937
SMILES OCCN1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1Cl)Cl)c(=O)n(c(=O)n2C)C
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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 C21H26Cl2N6O3 MW 481.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26Cl2N6O3/c1-25-19-18(20(31)26(2)21(25)32)29(12-14-3-4-15(22)11-16(14)23)17(24-19)13-28-7-5-27(6-8-28)9-10-30/h3-4,11,30H,5-10,12-13H2,1-2H3InChIKey
NWKKJPDVIRHXDP-UHFFFAOYSA-NSynonyms
851940-30-27((24DICHLOROPHENYL)METHYL)8((4(2HYDROXYETHYL)PIPERAZIN1YL)METHYL)13DIMETHYLPURINE26DIONE
7((24DICHLOROPHENYL)METHYL)8((4(2HYDROXYETHYL)PIPERAZINYL)METHYL)13DIMETHYL137TRIHYDROPURINE26DIONE
7(24dichlorobenzyl)8((4(2hydroxyethyl)piperazin1yl)methyl)13dimethyl1Hpurine26(3H7H)dione
7(24dichlorobenzyl)8((4(2hydroxyethyl)piperazin1yl)methyl)13dimethyl37dihydro1Hpurine26dione
851940302
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)CCO)CC4=C(C=C(C=C4)Cl)Cl
InChI=1SC21H26Cl2N6O3c1251918(20(31)26(2)21(25)32)29(12143415(22)1116(14)23)17(2419)13287527(6828)91030h341130H5101213H212H3
MFCD04466503
ZINC000020533389
ZINC20533389
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