Vitas-M small molecule compound
8-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK577429
SMILES CC(CCn1c(CN2CCN(CC2)c2ccccc2F)nc2c1c(=O)n(c(=O)n2C)C)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 C23H31FN6O2 MW 442.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31FN6O2/c1-16(2)9-10-30-19(25-21-20(30)22(31)27(4)23(32)26(21)3)15-28-11-13-29(14-12-28)18-8-6-5-7-17(18)24/h5-8,16H,9-15H2,1-4H3InChIKey
IWWVAJMLJTVXMC-UHFFFAOYSA-NSynonyms
851941-90-78((4(2fluorophenyl)piperazin1yl)methyl)13dimethyl7(3methylbutyl)37dihydro1Hpurine26dione
8((4(2FLUOROPHENYL)PIPERAZIN1YL)METHYL)13DIMETHYL7(3METHYLBUTYL)PURINE26DIONE
8((4(2fluorophenyl)piperazin1yl)methyl)7isopentyl13dimethyl1Hpurine26(3H7H)dione
8((4(2FLUOROPHENYL)PIPERAZINYL)METHYL)13DIMETHYL7(3METHYLBUTYL)137TRIHYDROPURINE26DIONE
851941907
CC(C)CCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCN(CC3)C4=CC=CC=C4F
InChI=1SC23H31FN6O2c116(2)9103019(252120(30)22(31)27(4)23(32)26(21)3)1528111329(141228)18865717(18)24h5816H915H214H3
MFCD04466679
ZINC000057010955
ZINC57010955
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