Vitas-M small molecule compound
7-(3-chlorobenzyl)-8-(3,4-dimethylphenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK000492
SMILES Clc1cccc(c1)Cn1c(Oc2ccc(c(c2)C)C)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 C22H21ClN4O3 MW 424.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN4O3/c1-13-8-9-17(10-14(13)2)30-21-24-19-18(20(28)26(4)22(29)25(19)3)27(21)12-15-6-5-7-16(23)11-15/h5-11H,12H2,1-4H3InChIKey
SQWCKXYXJZFCCK-UHFFFAOYSA-NSynonyms
359692-82-3359692823
7((3CHLOROPHENYL)METHYL)8(34DIMETHYLPHENOXY)13DIMETHYLPURINE26DIONE
7(3chlorobenzyl)8(34dimethylphenoxy)13dimethyl1Hpurine26(3H7H)dione
7(3CHLOROBENZYL)8(34DIMETHYLPHENOXY)13DIMETHYL37DIHYDRO1HPURINE26DIONE
CC1=C(C=C(C=C1)OC2=NC3=C(N2CC4=CC(=CC=C4)Cl)C(=O)N(C(=O)N3C)C)C
Clc1cccc(c1)Cn1c(Oc2ccc(c(c2)C)C)nc2c1c(=O)n(c(=O)n2C)C
InChI=1SC22H21ClN4O3c1138917(1014(13)2)3021241918(20(28)26(4)22(29)25(19)3)27(21)121565716(23)1115h511H12H214H3
MFCD01555390
STK000492
ZINC000008916267
ZINC08916267
ZINC8916267
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