N-{[6-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-{[6-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-3-(trifluoromethyl)benzamide
N-{[6-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | S554-0480 |
| Compound Name: | N-{[6-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 415.35 |
| Molecular Formula: | C20 H13 F4 N5 O |
| Smiles: | C(c1nnc2ccc(c3ccc(cc3)F)nn12)NC(c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4637 |
| logD: | 3.4636 |
| logSw: | -3.7824 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.787 |
| InChI Key: | RMAJACGRYQLPGT-UHFFFAOYSA-N |