2-{[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-{[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
2-{[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | F831-0588 |
| Compound Name: | 2-{[9-(4-fluorophenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 486.45 |
| Molecular Formula: | C22 H14 F4 N6 O S |
| Smiles: | C(C(Nc1ccccc1C(F)(F)F)=O)Sc1nnc2c3cc(c4ccc(cc4)F)nn3ccn12 |
| Stereo: | ACHIRAL |
| logP: | 3.7655 |
| logD: | 3.743 |
| logSw: | -4.1456 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.76 |
| InChI Key: | MMZZDXOKTDGOFE-UHFFFAOYSA-N |