2-{[7-oxo-2-(thiophen-2-yl)-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-{[7-oxo-2-(thiophen-2-yl)-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
2-{[7-oxo-2-(thiophen-2-yl)-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | G199-1891 |
| Compound Name: | 2-{[7-oxo-2-(thiophen-2-yl)-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 451.45 |
| Molecular Formula: | C18 H12 F3 N5 O2 S2 |
| Smiles: | C(C(Nc1cccc(c1)C(F)(F)F)=O)SC1=NC(c2cccs2)=NC2=CC(NN12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6034 |
| logD: | 3.6031 |
| logSw: | -3.8766 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.101 |
| InChI Key: | STSOZUBIVHFPQS-UHFFFAOYSA-N |