8-{4-[(3,5-dichloropyridin-2-yl)oxy]phenoxy}-7-[(2-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-{4-[(3,5-dichloropyridin-2-yl)oxy]phenoxy}-7-[(2-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-{4-[(3,5-dichloropyridin-2-yl)oxy]phenoxy}-7-[(2-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8013-0348 |
| Compound Name: | 8-{4-[(3,5-dichloropyridin-2-yl)oxy]phenoxy}-7-[(2-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 542.35 |
| Molecular Formula: | C25 H18 Cl2 F N5 O4 |
| Smiles: | CN1C(c2c(nc(n2Cc2ccccc2F)Oc2ccc(cc2)Oc2c(cc(cn2)[Cl])[Cl])N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2058 |
| logD: | 6.2058 |
| logSw: | -6.1599 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.395 |
| InChI Key: | GNBGJCQFYYOCBE-UHFFFAOYSA-N |