Vitas-M small molecule compound
8-(4-cyclohexylphenoxy)-1,3-dimethyl-7-(2-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK772841
SMILES Cc1ccccc1Cn1c(Oc2ccc(cc2)C2CCCCC2)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 C27H30N4O3 MW 458.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O3/c1-18-9-7-8-12-21(18)17-31-23-24(29(2)27(33)30(3)25(23)32)28-26(31)34-22-15-13-20(14-16-22)19-10-5-4-6-11-19/h7-9,12-16,19H,4-6,10-11,17H2,1-3H3InChIKey
DXWKSARGMQNKKZ-UHFFFAOYSA-NSynonyms
8(4CYCLOHEXYLPHENOXY)13DIMETHYL7((2METHYLPHENYL)METHYL)PURINE26DIONE
8(4cyclohexylphenoxy)13dimethyl7(2methylbenzyl)37dihydro1Hpurine26dione
CC1=CC=CC=C1CN2C3=C(N=C2OC4=CC=C(C=C4)C5CCCCC5)N(C(=O)N(C3=O)C)C
InChI=1SC27H30N4O3c1189781221(18)17312324(29(2)27(33)30(3)25(23)32)2826(31)3422151320(141622)19105461119h79121619H46101117H213H3
MFCD03820861
ZINC000001078496
ZINC01078496
ZINC1078496
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