Vitas-M small molecule compound
2-[4-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperazin-1-yl]ethyl cyclohexanecarboxylate
Catalog ID
STK272379
SMILES O=C(C1CCCCC1)OCCN1CCN(CC1)c1[nH]c2c(n1)n(C)c(=O)n(c2=O)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 C20H30N6O4 MW 418.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H30N6O4/c1-23-16-15(17(27)24(2)20(23)29)21-19(22-16)26-10-8-25(9-11-26)12-13-30-18(28)14-6-4-3-5-7-14/h14H,3-13H2,1-2H3,(H,21,22)InChIKey
GDZUKCCWURYQAF-UHFFFAOYSA-NSynonyms
2(4(13DIMETHYL26DIOXO137TRIHYDROPURIN8YL)PIPERAZINYL)ETHYLCYCLOHEXANECARBOXYLATE
2(4(13dimethyl26dioxo2367tetrahydro1Hpurin8yl)piperazin1yl)ethylcyclohexanecarboxylate
2(4(13dimethyl26dioxo7Hpurin8yl)piperazin1yl)ethylcyclohexanecarboxylate
CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCN(CC3)CCOC(=O)C4CCCCC4
InChI=1SC20H30N6O4c1231615(17(27)24(2)20(23)29)2119(2216)2610825(91126)12133018(28)146435714h14H313H212H3(H2122)
MFCD07037412
ZINC000054263482
ZINC54263482
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