Vitas-M small molecule compound
4-(7-benzyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)-N-phenylpiperazine-1-carboxamide
Catalog ID
STK262745
SMILES O=C(N1CCN(CC1)c1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C)Nc1ccccc1
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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 C25H27N7O3 MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N7O3/c1-28-21-20(22(33)29(2)25(28)35)32(17-18-9-5-3-6-10-18)23(27-21)30-13-15-31(16-14-30)24(34)26-19-11-7-4-8-12-19/h3-12H,13-17H2,1-2H3,(H,26,34)InChIKey
HHUOKWNQXITVIJ-UHFFFAOYSA-NSynonyms
(4(13DIMETHYL26DIOXO7BENZYL(137TRIHYDROPURIN8YL))PIPERAZINYL)NBENZAMIDE
4(7benzyl13dimethyl26dioxo2367tetrahydro1Hpurin8yl)Nphenylpiperazine1carboxamide
4(7benzyl13dimethyl26dioxopurin8yl)Nphenylpiperazine1carboxamide
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCN(CC3)C(=O)NC4=CC=CC=C4)CC5=CC=CC=C5
InChI=1SC25H27N7O3c1282120(22(33)29(2)25(28)35)32(171895361018)23(2721)30131531(161430)24(34)2619117481219h312H1317H212H3(H2634)
MFCD07626887
ZINC000008775429
ZINC08775429
ZINC8775429
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