8-{[(3-fluorophenyl)methyl]sulfanyl}-9-(4-methylphenyl)-1,9-dihydro-6H-purin-6-one
Chemical Structure Depiction of
8-{[(3-fluorophenyl)methyl]sulfanyl}-9-(4-methylphenyl)-1,9-dihydro-6H-purin-6-one
8-{[(3-fluorophenyl)methyl]sulfanyl}-9-(4-methylphenyl)-1,9-dihydro-6H-purin-6-one
Compound characteristics
| Compound ID: | G754-0340 |
| Compound Name: | 8-{[(3-fluorophenyl)methyl]sulfanyl}-9-(4-methylphenyl)-1,9-dihydro-6H-purin-6-one |
| Molecular Weight: | 366.41 |
| Molecular Formula: | C19 H15 F N4 O S |
| Smiles: | Cc1ccc(cc1)n1c2c(C(NC=N2)=O)nc1SCc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 3.6736 |
| logD: | 3.6724 |
| logSw: | -3.8882 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.174 |
| InChI Key: | KTBPKSAJRKGYLS-UHFFFAOYSA-N |