Vitas-M small molecule compound
8-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(3-oxobutan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK848376
SMILES CC(=O)C(n1c(CN2CCN(CC2)C(=O)c2ccco2)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 C21H26N6O5 MW 442.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N6O5/c1-13(14(2)28)27-16(22-18-17(27)20(30)24(4)21(31)23(18)3)12-25-7-9-26(10-8-25)19(29)15-6-5-11-32-15/h5-6,11,13H,7-10,12H2,1-4H3InChIKey
JYDKLQGCTURWBE-UHFFFAOYSA-NSynonyms
872628-08-58((4(2FURYLCARBONYL)PIPERAZINYL)METHYL)13DIMETHYL7(1METHYL2OXOPROPYL)137TRIHYDROPURINE26DIONE
8((4(FURAN2CARBONYL)PIPERAZIN1YL)METHYL)13DIMETHYL7(3OXOBUTAN2YL)1HPURINE26(3H7H)DIONE
8((4(FURAN2CARBONYL)PIPERAZIN1YL)METHYL)13DIMETHYL7(3OXOBUTAN2YL)PURINE26DIONE
8((4(furan2ylcarbonyl)piperazin1yl)methyl)13dimethyl7(3oxobutan2yl)37dihydro1Hpurine26dione
872628085
CC(C(=O)C)N1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCN(CC3)C(=O)C4=CC=CO4
InChI=1SC21H26N6O5c113(14(2)28)2716(221817(27)20(30)24(4)21(31)23(18)3)12257926(10825)19(29)1565113215h561113H71012H214H3
MFCD06406143
ZINC000020533302
ZINC000020533303
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