8-{[(4-methylphenyl)methyl]sulfanyl}-9-phenyl-1,9-dihydro-6H-purin-6-one
Chemical Structure Depiction of
8-{[(4-methylphenyl)methyl]sulfanyl}-9-phenyl-1,9-dihydro-6H-purin-6-one
8-{[(4-methylphenyl)methyl]sulfanyl}-9-phenyl-1,9-dihydro-6H-purin-6-one
Compound characteristics
| Compound ID: | G754-0121 |
| Compound Name: | 8-{[(4-methylphenyl)methyl]sulfanyl}-9-phenyl-1,9-dihydro-6H-purin-6-one |
| Molecular Weight: | 348.42 |
| Molecular Formula: | C19 H16 N4 O S |
| Smiles: | Cc1ccc(CSc2nc3C(NC=Nc3n2c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1524 |
| logD: | 3.1511 |
| logSw: | -3.3588 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.174 |
| InChI Key: | PXPSFOCXILCYME-UHFFFAOYSA-N |