Vitas-M small molecule compound
8-[(4-benzylpiperazin-1-yl)methyl]-7-(2-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK598948
SMILES Fc1ccccc1Cn1c(CN2CCN(CC2)Cc2ccccc2)nc2c1c(=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 C26H29FN6O2 MW 476.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29FN6O2/c1-29-24-23(25(34)30(2)26(29)35)33(17-20-10-6-7-11-21(20)27)22(28-24)18-32-14-12-31(13-15-32)16-19-8-4-3-5-9-19/h3-11H,12-18H2,1-2H3InChIKey
PWFTZWCWZYOWKX-UHFFFAOYSA-NSynonyms
851939-45-27((2FLUOROPHENYL)METHYL)13DIMETHYL8((4BENZYLPIPERAZINYL)METHYL)137TRIHYDROPURINE26DIONE
8((4BENZYLPIPERAZIN1YL)METHYL)7((2FLUOROPHENYL)METHYL)13DIMETHYLPURINE26DIONE
8((4benzylpiperazin1yl)methyl)7(2fluorobenzyl)13dimethyl1Hpurine26(3H7H)dione
8((4benzylpiperazin1yl)methyl)7(2fluorobenzyl)13dimethyl37dihydro1Hpurine26dione
851939452
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)CC4=CC=CC=C4)CC5=CC=CC=C5F
InChI=1SC26H29FN6O2c1292423(25(34)30(2)26(29)35)33(172010671121(20)27)22(2824)1832141231(131532)16198435919h311H1218H212H3
MFCD04466445
ZINC000020533295
ZINC20533295
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