8-({[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9-[(oxolan-2-yl)methyl]-1,9-dihydro-6H-purin-6-one
Chemical Structure Depiction of
8-({[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9-[(oxolan-2-yl)methyl]-1,9-dihydro-6H-purin-6-one
8-({[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9-[(oxolan-2-yl)methyl]-1,9-dihydro-6H-purin-6-one
Compound characteristics
| Compound ID: | G754-0456 |
| Compound Name: | 8-({[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-9-[(oxolan-2-yl)methyl]-1,9-dihydro-6H-purin-6-one |
| Molecular Weight: | 457.94 |
| Molecular Formula: | C21 H20 Cl N5 O3 S |
| Smiles: | Cc1c(CSc2nc3C(NC=Nc3n2CC2CCCO2)=O)nc(c2ccccc2[Cl])o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.953 |
| logD: | 2.9524 |
| logSw: | -3.6711 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.207 |
| InChI Key: | HUTZMTVZIYWLOY-CYBMUJFWSA-N |