Vitas-M small molecule compound
1-(4-chlorobenzyl)-8-(2,5-dimethylphenoxy)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK038241
SMILES Clc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)Oc1cc(C)ccc1C
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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 C22H21ClN4O3 MW 424.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN4O3/c1-13-5-6-14(2)17(11-13)30-21-24-19-18(25(21)3)20(28)27(22(29)26(19)4)12-15-7-9-16(23)10-8-15/h5-11H,12H2,1-4H3InChIKey
OEDJYOCNEGCGBW-UHFFFAOYSA-NSynonyms
327101-02-01((4CHLOROPHENYL)METHYL)8(25DIMETHYLPHENOXY)37DIMETHYLPURINE26DIONE
1(4chlorobenzyl)8(25dimethylphenoxy)37dimethyl1Hpurine26(3H7H)dione
1(4CHLOROBENZYL)8(25DIMETHYLPHENOXY)37DIMETHYL37DIHYDRO1HPURINE26DIONE
327101020
CC1=CC(=C(C=C1)C)OC2=NC3=C(N2C)C(=O)N(C(=O)N3C)CC4=CC=C(C=C4)Cl
Clc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)Oc1cc(C)ccc1C
InChI=1SC22H21ClN4O3c1135614(2)17(1113)3021241918(25(21)3)20(28)27(22(29)26(19)4)12157916(23)10815h511H12H214H3
MFCD01554846
STK038241
ZINC000008926365
ZINC08926365
ZINC8926365
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