Vitas-M small molecule compound
7-benzyl-8-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK579708
SMILES Clc1cccc(c1)N1CCN(CC1)Cc1nc2c(n1Cc1ccccc1)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 C25H27ClN6O2 MW 478.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27ClN6O2/c1-28-23-22(24(33)29(2)25(28)34)32(16-18-7-4-3-5-8-18)21(27-23)17-30-11-13-31(14-12-30)20-10-6-9-19(26)15-20/h3-10,15H,11-14,16-17H2,1-2H3InChIKey
PMJINWQTJFICES-UHFFFAOYSA-NSynonyms
851937-79-67benzyl8((4(3chlorophenyl)piperazin1yl)methyl)13dimethyl1Hpurine26(3H7H)dione
7benzyl8((4(3chlorophenyl)piperazin1yl)methyl)13dimethyl37dihydro1Hpurine26dione
7BENZYL8((4(3CHLOROPHENYL)PIPERAZIN1YL)METHYL)13DIMETHYLPURINE26DIONE
8((4(3CHLOROPHENYL)PIPERAZINYL)METHYL)13DIMETHYL7BENZYL137TRIHYDROPURINE26DIONE
851937796
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)C4=CC(=CC=C4)Cl)CC5=CC=CC=C5
InChI=1SC25H27ClN6O2c1282322(24(33)29(2)25(28)34)32(16187435818)21(2723)1730111331(141230)20106919(26)1520h31015H11141617H212H3
MFCD04466282
ZINC000057105564
ZINC57105564
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