8-{[(4-methoxyphenyl)methyl]sulfanyl}-9-(4-methylphenyl)-1,9-dihydro-6H-purin-6-one
Chemical Structure Depiction of
8-{[(4-methoxyphenyl)methyl]sulfanyl}-9-(4-methylphenyl)-1,9-dihydro-6H-purin-6-one
8-{[(4-methoxyphenyl)methyl]sulfanyl}-9-(4-methylphenyl)-1,9-dihydro-6H-purin-6-one
Compound characteristics
| Compound ID: | G754-0348 |
| Compound Name: | 8-{[(4-methoxyphenyl)methyl]sulfanyl}-9-(4-methylphenyl)-1,9-dihydro-6H-purin-6-one |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C20 H18 N4 O2 S |
| Smiles: | Cc1ccc(cc1)n1c2c(C(NC=N2)=O)nc1SCc1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.2563 |
| logD: | 3.2551 |
| logSw: | -3.5385 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.718 |
| InChI Key: | XZSVGKAEAMDRKL-UHFFFAOYSA-N |