Vitas-M small molecule compound
8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK574905
SMILES Fc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1CCCc1ccccc1)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 C27H31FN6O2 MW 490.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31FN6O2/c1-30-25-24(26(35)31(2)27(30)36)34(14-6-9-20-7-4-3-5-8-20)23(29-25)19-32-15-17-33(18-16-32)22-12-10-21(28)11-13-22/h3-5,7-8,10-13H,6,9,14-19H2,1-2H3InChIKey
YWFUKHBKADFSCL-UHFFFAOYSA-NSynonyms
851943-19-68((4(4fluorophenyl)piperazin1yl)methyl)13dimethyl7(3phenylpropyl)1Hpurine26(3H7H)dione
8((4(4fluorophenyl)piperazin1yl)methyl)13dimethyl7(3phenylpropyl)37dihydro1Hpurine26dione
8((4(4FLUOROPHENYL)PIPERAZIN1YL)METHYL)13DIMETHYL7(3PHENYLPROPYL)PURINE26DIONE
8((4(4FLUOROPHENYL)PIPERAZINYL)METHYL)13DIMETHYL7(3PHENYLPROPYL)137TRIHYDROPURINE26DIONE
851943196
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)C4=CC=C(C=C4)F)CCCC5=CC=CC=C5
InChI=1SC27H31FN6O2c1302524(26(35)31(2)27(30)36)34(1469207435820)23(2925)1932151733(181632)22121021(28)111322h35781013H691419H212H3
MFCD04466739
ZINC000057099758
ZINC57099758
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