1-(4-methylphenyl)-6-[(prop-2-en-1-yl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
1-(4-methylphenyl)-6-[(prop-2-en-1-yl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
1-(4-methylphenyl)-6-[(prop-2-en-1-yl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C365-0176 |
| Compound Name: | 1-(4-methylphenyl)-6-[(prop-2-en-1-yl)sulfanyl]-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 298.36 |
| Molecular Formula: | C15 H14 N4 O S |
| Smiles: | Cc1ccc(cc1)n1c2c(cn1)C(NC(=N2)SCC=C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4317 |
| logD: | 3.3542 |
| logSw: | -3.5849 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.723 |
| InChI Key: | WGXQKOISPMOUMJ-UHFFFAOYSA-N |