Vitas-M small molecule compound
8-[(1,3-benzodioxol-5-ylmethyl)amino]-7-(2-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL297913
SMILES Fc1ccccc1Cn1c(NCc2ccc3c(c2)OCO3)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 C22H20FN5O4 MW 437.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20FN5O4/c1-26-19-18(20(29)27(2)22(26)30)28(11-14-5-3-4-6-15(14)23)21(25-19)24-10-13-7-8-16-17(9-13)32-12-31-16/h3-9H,10-12H2,1-2H3,(H,24,25)InChIKey
GIBLGVWWFIPENH-UHFFFAOYSA-NSynonyms
305863-03-0305863030
7(2FLUOROBENZYL)13DIMETHYL8(PIPERONYLAMINO)XANTHINE
8((13benzodioxol5ylmethyl)amino)7(2fluorobenzyl)13dimethyl37dihydro1Hpurine26dione
8((benzo(d)(13)dioxol5ylmethyl)amino)7(2fluorobenzyl)13dimethyl1Hpurine26(3H7H)dione
8(13BENZODIOXOL5YLMETHYLAMINO)7((2FLUOROPHENYL)METHYL)13DIMETHYLPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCC3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5F
InChI=1SC22H20FN5O4c1261918(20(29)27(2)22(26)30)28(1114534615(14)23)21(2519)241013781617(913)32123116h39H1012H212H3(H2425)
MFCD01553683
ZINC000002345333
ZINC02345333
ZINC2345333
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