2-(4-methylphenyl)-4-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
2-(4-methylphenyl)-4-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
2-(4-methylphenyl)-4-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
| Compound ID: | G199-0352 |
| Compound Name: | 2-(4-methylphenyl)-4-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
| Molecular Weight: | 369.44 |
| Molecular Formula: | C18 H19 N5 O2 S |
| Smiles: | Cc1ccc(cc1)C1=NC2=CC(NN2C(=N1)SCC(N1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1905 |
| logD: | 2.1905 |
| logSw: | -2.5186 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.691 |
| InChI Key: | KNAQJCODKLYFIX-UHFFFAOYSA-N |