Vitas-M small molecule compound
1-{[7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}piperidine-4-carboxamide
Catalog ID
STK573333
SMILES NC(=O)C1CCN(CC1)Cc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)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 C21H24ClFN6O3 MW 462.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClFN6O3/c1-26-19-17(20(31)27(2)21(26)32)29(10-13-14(22)4-3-5-15(13)23)16(25-19)11-28-8-6-12(7-9-28)18(24)30/h3-5,12H,6-11H2,1-2H3,(H2,24,30)InChIKey
FPKJXJHXHLQYAQ-UHFFFAOYSA-NSynonyms
893970-01-91((7((2CHLORO6FLUOROPHENYL)METHYL)13DIMETHYL26DIOXOPURIN8YL)METHYL)PIPERIDINE4CARBOXAMIDE
1((7((6CHLORO2FLUOROPHENYL)METHYL)13DIMETHYL26DIOXO137TRIHYDROPURIN8YL)METHYL)PIPERIDINE4CARBOXAMIDE
1((7(2chloro6fluorobenzyl)13dimethyl26dioxo2367tetrahydro1Hpurin8yl)methyl)piperidine4carboxamide
893970019
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCC(CC3)C(=O)N)CC4=C(C=CC=C4Cl)F
InChI=1SC21H24ClFN6O3c1261917(20(31)27(2)21(26)32)29(101314(22)43515(13)23)16(2519)11288612(7928)18(24)30h3512H611H212H3(H22430)
MFCD06596666
ZINC000002205248
ZINC2205248
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