8-{[(4-fluorophenyl)methyl]sulfanyl}-9-phenyl-1,9-dihydro-6H-purin-6-one
Chemical Structure Depiction of
8-{[(4-fluorophenyl)methyl]sulfanyl}-9-phenyl-1,9-dihydro-6H-purin-6-one
8-{[(4-fluorophenyl)methyl]sulfanyl}-9-phenyl-1,9-dihydro-6H-purin-6-one
Compound characteristics
| Compound ID: | G754-0171 |
| Compound Name: | 8-{[(4-fluorophenyl)methyl]sulfanyl}-9-phenyl-1,9-dihydro-6H-purin-6-one |
| Molecular Weight: | 352.39 |
| Molecular Formula: | C18 H13 F N4 O S |
| Smiles: | C(c1ccc(cc1)F)Sc1nc2C(NC=Nc2n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.758 |
| logD: | 2.7568 |
| logSw: | -3.1632 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.174 |
| InChI Key: | LUKUECZLJYGKMW-UHFFFAOYSA-N |