Vitas-M small molecule compound
8-[(1,3-benzodioxol-5-ylmethyl)amino]-1-(4-fluorobenzyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK012791
SMILES Fc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)NCc1ccc2c(c1)OCO2
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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 C22H20FN5O4 MW 437.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20FN5O4/c1-26-18-19(25-21(26)24-10-14-5-8-16-17(9-14)32-12-31-16)27(2)22(30)28(20(18)29)11-13-3-6-15(23)7-4-13/h3-9H,10-12H2,1-2H3,(H,24,25)InChIKey
FSZKYFIFMMXAST-UHFFFAOYSA-NSynonyms
304879-74-1304879741
8((13BENZODIOXOL5YLMETHYL)AMINO)1(4FLUOROBENZYL)37DIMETHYL37DIHYDRO1HPURINE26DIONE
8((2HBENZO(34D)13DIOXOLAN5YLMETHYL)AMINO)1((4FLUOROPHENYL)METHYL)37DIMETHYL137TRIHYDROPURINE26DIONE
8((benzo(d)(13)dioxol5ylmethyl)amino)1(4fluorobenzyl)37dimethyl1Hpurine26(3H7H)dione
8(13BENZODIOXOL5YLMETHYLAMINO)1((4FLUOROPHENYL)METHYL)37DIMETHYLPURINE26DIONE
CN1C2=C(N=C1NCC3=CC4=C(C=C3)OCO4)N(C(=O)N(C2=O)CC5=CC=C(C=C5)F)C
Fc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)NCc1ccc2c(c1)OCO2
InChI=1SC22H20FN5O4c1261819(2521(26)241014581617(914)32123116)27(2)22(30)28(20(18)29)11133615(23)7413h39H1012H212H3(H2425)
MFCD01553530
STK012791
ZINC000000789684
ZINC00789684
ZINC789684
Check stock
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Check stock on Vitas-MAvailable files
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