8-({[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)-9-[(oxolan-2-yl)methyl]-1,9-dihydro-6H-purin-6-one
Chemical Structure Depiction of
8-({[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)-9-[(oxolan-2-yl)methyl]-1,9-dihydro-6H-purin-6-one
8-({[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)-9-[(oxolan-2-yl)methyl]-1,9-dihydro-6H-purin-6-one
Compound characteristics
| Compound ID: | G754-0460 |
| Compound Name: | 8-({[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)-9-[(oxolan-2-yl)methyl]-1,9-dihydro-6H-purin-6-one |
| Molecular Weight: | 437.52 |
| Molecular Formula: | C22 H23 N5 O3 S |
| Smiles: | Cc1ccccc1c1nc(CSc2nc3C(NC=Nc3n2CC2CCCO2)=O)c(C)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7732 |
| logD: | 2.7725 |
| logSw: | -3.2799 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.207 |
| InChI Key: | FVPLPWNFIMUOCD-OAHLLOKOSA-N |