2-[(2-chloro-4-fluorophenyl)methyl]-N-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
Chemical Structure Depiction of
2-[(2-chloro-4-fluorophenyl)methyl]-N-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
2-[(2-chloro-4-fluorophenyl)methyl]-N-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
Compound characteristics
| Compound ID: | SC27-2159 |
| Compound Name: | 2-[(2-chloro-4-fluorophenyl)methyl]-N-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide |
| Molecular Weight: | 432.88 |
| Molecular Formula: | C20 H22 Cl F N6 O2 |
| Smiles: | Cc1nccn1CCNC(C1CCCN2C1=NN(Cc1ccc(cc1[Cl])F)C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9612 |
| logD: | 0.9893 |
| logSw: | -2.8612 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.997 |
| InChI Key: | OGOKFHKMTVTKFW-MRXNPFEDSA-N |