Vitas-M small molecule compound
7-(4-fluorobenzyl)-8-[(4-hydroxybutyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK697891
SMILES OCCCCNc1nc2c(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 C18H22FN5O3 MW 375.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22FN5O3/c1-22-15-14(16(26)23(2)18(22)27)24(11-12-5-7-13(19)8-6-12)17(21-15)20-9-3-4-10-25/h5-8,25H,3-4,9-11H2,1-2H3,(H,20,21)InChIKey
FYVRTNDTFAVLRV-UHFFFAOYSA-NSynonyms
359907-27-0359907270
7((4FLUOROPHENYL)METHYL)8(4HYDROXYBUTYLAMINO)13DIMETHYLPURINE26DIONE
7(4fluorobenzyl)8((4hydroxybutyl)amino)13dimethyl1Hpurine26(3H7H)dione
7(4fluorobenzyl)8((4hydroxybutyl)amino)13dimethyl37dihydro1Hpurine26dione
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCCCO)CC3=CC=C(C=C3)F
InChI=1SC18H22FN5O3c1221514(16(26)23(2)18(22)27)24(11125713(19)8612)17(2115)209341025h5825H34911H212H3(H2021)
MFCD00837008
ZINC000013512407
ZINC13512407
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