Vitas-M small molecule compound
7-(2-chlorobenzyl)-8-(4-chloro-2-cyclohexylphenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL381958
SMILES Clc1ccc(c(c1)C1CCCCC1)Oc1nc2c(n1Cc1ccccc1Cl)c(=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 C26H26Cl2N4O3 MW 513.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26Cl2N4O3/c1-30-23-22(24(33)31(2)26(30)34)32(15-17-10-6-7-11-20(17)28)25(29-23)35-21-13-12-18(27)14-19(21)16-8-4-3-5-9-16/h6-7,10-14,16H,3-5,8-9,15H2,1-2H3InChIKey
BDEFCSVWFIJFCW-UHFFFAOYSA-NSynonyms
7(2chlorobenzyl)8(4chloro2cyclohexylphenoxy)13dimethyl37dihydro1Hpurine26dione
8(4CHLORO2CYCLOHEXYLPHENOXY)7((2CHLOROPHENYL)METHYL)13DIMETHYLPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC3=C(C=C(C=C3)Cl)C4CCCCC4)CC5=CC=CC=C5Cl
InChI=1SC26H26Cl2N4O3c1302322(24(33)31(2)26(30)34)32(151710671120(17)28)25(2923)3521131218(27)1419(21)168435916h67101416H358915H212H3
MFCD03235410
ZINC000008442489
ZINC08442489
ZINC8442489
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