2-(2-methylphenyl)-4-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
2-(2-methylphenyl)-4-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
2-(2-methylphenyl)-4-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
| Compound ID: | G199-0136 |
| Compound Name: | 2-(2-methylphenyl)-4-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
| Molecular Weight: | 397.5 |
| Molecular Formula: | C20 H23 N5 O2 S |
| Smiles: | CC1CCN(CC1)C(CSC1=NC(c2ccccc2C)=NC2=CC(NN12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5498 |
| logD: | 2.5498 |
| logSw: | -2.8547 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.325 |
| InChI Key: | XUTOZDDWPCLRHD-UHFFFAOYSA-N |