2-{[3-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-{[3-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
2-{[3-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | C742-0285 |
| Compound Name: | 2-{[3-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 447.41 |
| Molecular Formula: | C20 H13 F4 N5 O S |
| Smiles: | C(C(Nc1cccc(c1)C(F)(F)F)=O)Sc1ccc2nnc(c3ccc(cc3)F)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5725 |
| logD: | 4.5719 |
| logSw: | -4.52 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.636 |
| InChI Key: | JQVOSKCYBNMECQ-UHFFFAOYSA-N |