Vitas-M small molecule compound
7-(2-chloro-6-fluorobenzyl)-8-(2,5-dimethylphenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK022779
SMILES Cc1ccc(c(c1)Oc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C)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 C22H20ClFN4O3 MW 442.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClFN4O3/c1-12-8-9-13(2)17(10-12)31-21-25-19-18(20(29)27(4)22(30)26(19)3)28(21)11-14-15(23)6-5-7-16(14)24/h5-10H,11H2,1-4H3InChIKey
VMLFEAXRXALYGS-UHFFFAOYSA-NSynonyms
7((2CHLORO6FLUOROPHENYL)METHYL)8(25DIMETHYLPHENOXY)13DIMETHYLPURINE26DIONE
7(2CHLORO6FLUOROBENZYL)8(25DIMETHYLPHENOXY)13DIMETHYL37DIHYDRO1HPURINE26DIONE
CC1=CC(=C(C=C1)C)OC2=NC3=C(N2CC4=C(C=CC=C4Cl)F)C(=O)N(C(=O)N3C)C
Cc1ccc(c(c1)Oc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C)C
InChI=1SC22H20ClFN4O3c1128913(2)17(1012)3121251918(20(29)27(4)22(30)26(19)3)28(21)111415(23)65716(14)24h510H11H214H3
MFCD05819705
STK022779
ZINC000008985763
ZINC08985763
ZINC8985763
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