4-{[(4-methylphenyl)methyl]sulfanyl}-2-(thiophen-2-yl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Chemical Structure Depiction of
4-{[(4-methylphenyl)methyl]sulfanyl}-2-(thiophen-2-yl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
4-{[(4-methylphenyl)methyl]sulfanyl}-2-(thiophen-2-yl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one
Compound characteristics
| Compound ID: | G199-1966 |
| Compound Name: | 4-{[(4-methylphenyl)methyl]sulfanyl}-2-(thiophen-2-yl)pyrazolo[1,5-a][1,3,5]triazin-7(6H)-one |
| Molecular Weight: | 354.45 |
| Molecular Formula: | C17 H14 N4 O S2 |
| Smiles: | Cc1ccc(CSC2=NC(c3cccs3)=NC3=CC(NN23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.308 |
| logD: | 3.308 |
| logSw: | -3.4998 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.951 |
| InChI Key: | VSZBOBZVYCLWMT-UHFFFAOYSA-N |