N-[2-(4-fluorophenyl)ethyl]-2-[(3-fluorophenyl)methyl]-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
Chemical Structure Depiction of
N-[2-(4-fluorophenyl)ethyl]-2-[(3-fluorophenyl)methyl]-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
N-[2-(4-fluorophenyl)ethyl]-2-[(3-fluorophenyl)methyl]-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
Compound characteristics
| Compound ID: | SC27-1941 |
| Compound Name: | N-[2-(4-fluorophenyl)ethyl]-2-[(3-fluorophenyl)methyl]-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide |
| Molecular Weight: | 412.44 |
| Molecular Formula: | C22 H22 F2 N4 O2 |
| Smiles: | C1CC(C2=NN(Cc3cccc(c3)F)C(N2C1)=O)C(NCCc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0663 |
| logD: | 3.0663 |
| logSw: | -3.2185 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.46 |
| InChI Key: | KENLRWBWPPPZKV-LJQANCHMSA-N |