Vitas-M small molecule compound
8-(1,3-benzodioxol-5-ylmethoxy)-1-(3-chlorobenzyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK697868
SMILES Clc1cccc(c1)Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)OCc1ccc2c(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 C22H19ClN4O5 MW 454.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O5/c1-25-18-19(24-21(25)30-11-14-6-7-16-17(9-14)32-12-31-16)26(2)22(29)27(20(18)28)10-13-4-3-5-15(23)8-13/h3-9H,10-12H2,1-2H3InChIKey
HPHMOLBQWWJKAZ-UHFFFAOYSA-NSynonyms
368840-97-5368840975
8(13BENZODIOXOL5YLMETHOXY)1((3CHLOROPHENYL)METHYL)37DIMETHYLPURINE26DIONE
8(13benzodioxol5ylmethoxy)1(3chlorobenzyl)37dimethyl37dihydro1Hpurine26dione
8(benzo(d)(13)dioxol5ylmethoxy)1(3chlorobenzyl)37dimethyl1Hpurine26(3H7H)dione
CN1C2=C(N=C1OCC3=CC4=C(C=C3)OCO4)N(C(=O)N(C2=O)CC5=CC(=CC=C5)Cl)C
InChI=1SC22H19ClN4O5c1251819(2421(25)301114671617(914)32123116)26(2)22(29)27(20(18)28)101343515(23)813h39H1012H212H3
MFCD01555095
ZINC000038139323
ZINC38139323
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