6-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-(4-methylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
6-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-(4-methylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
6-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-(4-methylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C365-0192 |
| Compound Name: | 6-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-(4-methylphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 376.48 |
| Molecular Formula: | C21 H20 N4 O S |
| Smiles: | Cc1ccc(cc1)n1c2c(cn1)C(NC(=N2)SCc1cc(C)ccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3628 |
| logD: | 5.324 |
| logSw: | -5.108 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.452 |
| InChI Key: | GKAZHBLJISIJNC-UHFFFAOYSA-N |