8-(4-chloro-2-cyclohexylphenoxy)-7-[(2-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-(4-chloro-2-cyclohexylphenoxy)-7-[(2-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-(4-chloro-2-cyclohexylphenoxy)-7-[(2-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 6265-0001 |
| Compound Name: | 8-(4-chloro-2-cyclohexylphenoxy)-7-[(2-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 496.97 |
| Molecular Formula: | C26 H26 Cl F N4 O3 |
| Smiles: | CN1C(c2c(nc(n2Cc2ccccc2F)Oc2ccc(cc2C2CCCCC2)[Cl])N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7914 |
| logD: | 6.7914 |
| logSw: | -6.2959 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.76 |
| InChI Key: | GILZIYNJSLAYOI-UHFFFAOYSA-N |