2-[(2,5-dimethylphenyl)methyl]-N-{2-[ethyl(phenyl)amino]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-[(2,5-dimethylphenyl)methyl]-N-{2-[ethyl(phenyl)amino]ethyl}-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
2-[(2,5-dimethylphenyl)methyl]-N-{2-[ethyl(phenyl)amino]ethyl}-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
Compound characteristics
| Compound ID: | SC27-2118 |
| Compound Name: | 2-[(2,5-dimethylphenyl)methyl]-N-{2-[ethyl(phenyl)amino]ethyl}-3-oxo-2,3,5,6,7,8-hexahydro[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C26 H33 N5 O2 |
| Smiles: | CCN(CCNC(C1CCCN2C1=NN(Cc1cc(C)ccc1C)C2=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5529 |
| logD: | 4.5516 |
| logSw: | -4.1265 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.45 |
| InChI Key: | BAUOODTXGIGVOG-HSZRJFAPSA-N |