N-(5-methyl-1,2-oxazol-3-yl)-2-{[1-(4-methylphenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(5-methyl-1,2-oxazol-3-yl)-2-{[1-(4-methylphenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide
N-(5-methyl-1,2-oxazol-3-yl)-2-{[1-(4-methylphenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G856-2492 |
| Compound Name: | N-(5-methyl-1,2-oxazol-3-yl)-2-{[1-(4-methylphenyl)-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide |
| Molecular Weight: | 396.43 |
| Molecular Formula: | C18 H16 N6 O3 S |
| Smiles: | Cc1ccc(cc1)n1c2c(cn1)C(NC(=N2)SCC(Nc1cc(C)on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9075 |
| logD: | 2.8445 |
| logSw: | -3.3577 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.396 |
| InChI Key: | OHJLUVRLSLIOFV-UHFFFAOYSA-N |