Vitas-M small molecule compound
8-[(1,3-benzodioxol-5-ylmethyl)amino]-1-(2-fluorobenzyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK804487
SMILES Fc1ccccc1Cn1c(=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)24-10-13-7-8-16-17(9-13)32-12-31-16)27(2)22(30)28(20(18)29)11-14-5-3-4-6-15(14)23/h3-9H,10-12H2,1-2H3,(H,24,25)InChIKey
WYHIIFBPRHFGJL-UHFFFAOYSA-NSynonyms
369607-22-7369607227
8((13benzodioxol5ylmethyl)amino)1(2fluorobenzyl)37dimethyl37dihydro1Hpurine26dione
8((benzo(d)(13)dioxol5ylmethyl)amino)1(2fluorobenzyl)37dimethyl1Hpurine26(3H7H)dione
8(13BENZODIOXOL5YLMETHYLAMINO)1((2FLUOROPHENYL)METHYL)37DIMETHYLPURINE26DIONE
CN1C2=C(N=C1NCC3=CC4=C(C=C3)OCO4)N(C(=O)N(C2=O)CC5=CC=CC=C5F)C
InChI=1SC22H20FN5O4c1261819(2521(26)241013781617(913)32123116)27(2)22(30)28(20(18)29)1114534615(14)23h39H1012H212H3(H2425)
MFCD01556035
ZINC000001127313
ZINC01127313
ZINC1127313
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