Vitas-M small molecule compound
7-benzyl-1,3-dimethyl-8-[4-(tetrahydrofuran-2-ylcarbonyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK262588
SMILES O=C(N1CCN(CC1)c1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C)C1CCCO1
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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 C23H28N6O4 MW 452.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N6O4/c1-25-19-18(21(31)26(2)23(25)32)29(15-16-7-4-3-5-8-16)22(24-19)28-12-10-27(11-13-28)20(30)17-9-6-14-33-17/h3-5,7-8,17H,6,9-15H2,1-2H3InChIKey
FZADDMOCQQUWMS-UHFFFAOYSA-NSynonyms
13DIMETHYL8(4(OXOLAN2YLCARBONYL)PIPERAZINYL)7BENZYL137TRIHYDROPURINE26DIONE
7benzyl13dimethyl8(4(oxolane2carbonyl)piperazin1yl)purine26dione
7benzyl13dimethyl8(4(tetrahydrofuran2ylcarbonyl)piperazin1yl)37dihydro1Hpurine26dione
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCN(CC3)C(=O)C4CCCO4)CC5=CC=CC=C5
InChI=1SC23H28N6O4c1251918(21(31)26(2)23(25)32)29(15167435816)22(2419)28121027(111328)20(30)1796143317h357817H6915H212H3
MFCD07626816
ZINC000008775154
ZINC000008775157
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