Vitas-M small molecule compound
7-(4-chlorobenzyl)-8-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK587198
SMILES Clc1ccc(cc1)Cn1c(CN2CCN(CC2)c2ccccc2F)nc2c1c(=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 C25H26ClFN6O2 MW 496.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26ClFN6O2/c1-29-23-22(24(34)30(2)25(29)35)33(15-17-7-9-18(26)10-8-17)21(28-23)16-31-11-13-32(14-12-31)20-6-4-3-5-19(20)27/h3-10H,11-16H2,1-2H3InChIKey
NXEVVUALXUVGBD-UHFFFAOYSA-NSynonyms
851938-41-57((4CHLOROPHENYL)METHYL)8((4(2FLUOROPHENYL)PIPERAZIN1YL)METHYL)13DIMETHYLPURINE26DIONE
7((4CHLOROPHENYL)METHYL)8((4(2FLUOROPHENYL)PIPERAZINYL)METHYL)13DIMETHYL137TRIHYDROPURINE26DIONE
7(4chlorobenzyl)8((4(2fluorophenyl)piperazin1yl)methyl)13dimethyl1Hpurine26(3H7H)dione
7(4chlorobenzyl)8((4(2fluorophenyl)piperazin1yl)methyl)13dimethyl37dihydro1Hpurine26dione
851938415
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)C4=CC=CC=C4F)CC5=CC=C(C=C5)Cl
InChI=1SC25H26ClFN6O2c1292322(24(34)30(2)25(29)35)33(15177918(26)10817)21(2823)1631111332(141231)20643519(20)27h310H1116H212H3
MFCD04466343
ZINC000057120632
ZINC57120632
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