3-[6-(4-chlorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}propanamide
Chemical Structure Depiction of
3-[6-(4-chlorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}propanamide
3-[6-(4-chlorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | M454-0787 |
| Compound Name: | 3-[6-(4-chlorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-{[3-(trifluoromethyl)phenyl]methyl}propanamide |
| Molecular Weight: | 459.86 |
| Molecular Formula: | C22 H17 Cl F3 N5 O |
| Smiles: | C(Cc1nnc2ccc(c3ccc(cc3)[Cl])nn12)C(NCc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.987 |
| logD: | 3.987 |
| logSw: | -4.6125 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.573 |
| InChI Key: | HJVIBEXTVMAWCI-UHFFFAOYSA-N |