Vitas-M small molecule compound
7-(4-fluorobenzyl)-8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK599193
SMILES COc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1)F)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 C26H29FN6O3 MW 492.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29FN6O3/c1-29-24-23(25(34)30(2)26(29)35)33(16-18-4-6-19(27)7-5-18)22(28-24)17-31-12-14-32(15-13-31)20-8-10-21(36-3)11-9-20/h4-11H,12-17H2,1-3H3InChIKey
IFIOTVPRWBSFSO-UHFFFAOYSA-NSynonyms
851938-02-87((4FLUOROPHENYL)METHYL)8((4(4METHOXYPHENYL)PIPERAZIN1YL)METHYL)13DIMETHYLPURINE26DIONE
7((4FLUOROPHENYL)METHYL)8((4(4METHOXYPHENYL)PIPERAZINYL)METHYL)13DIMETHYL137TRIHYDROPURINE26DIONE
7(4fluorobenzyl)8((4(4methoxyphenyl)piperazin1yl)methyl)13dimethyl1Hpurine26(3H7H)dione
7(4fluorobenzyl)8((4(4methoxyphenyl)piperazin1yl)methyl)13dimethyl37dihydro1Hpurine26dione
851938028
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)C4=CC=C(C=C4)OC)CC5=CC=C(C=C5)F
InChI=1SC26H29FN6O3c1292423(25(34)30(2)26(29)35)33(16184619(27)7518)22(2824)1731121432(151331)2081021(363)11920h411H1217H213H3
MFCD04466304
ZINC000057128939
ZINC57128939
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