N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]-3-(trifluoromethyl)benzamide
N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | S554-0152 |
| Compound Name: | N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 397.36 |
| Molecular Formula: | C20 H14 F3 N5 O |
| Smiles: | C(c1nnc2ccc(c3ccccc3)nn12)NC(c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3296 |
| logD: | 3.3295 |
| logSw: | -3.6972 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.787 |
| InChI Key: | VPEGVCBOCFIQQY-UHFFFAOYSA-N |