8-(4-cyclohexylphenoxy)-1,3-dimethyl-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-(4-cyclohexylphenoxy)-1,3-dimethyl-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
8-(4-cyclohexylphenoxy)-1,3-dimethyl-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8014-9099 |
| Compound Name: | 8-(4-cyclohexylphenoxy)-1,3-dimethyl-7-[(2-methylphenyl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C27 H30 N4 O3 |
| Smiles: | Cc1ccccc1Cn1c2C(N(C)C(N(C)c2nc1Oc1ccc(cc1)C1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1346 |
| logD: | 7.1346 |
| logSw: | -5.6321 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.673 |
| InChI Key: | DXWKSARGMQNKKZ-UHFFFAOYSA-N |