N-ethyl-4-oxo-N-phenyl-4-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}butanamide
Chemical Structure Depiction of
N-ethyl-4-oxo-N-phenyl-4-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}butanamide
N-ethyl-4-oxo-N-phenyl-4-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}butanamide
Compound characteristics
| Compound ID: | S517-1117 |
| Compound Name: | N-ethyl-4-oxo-N-phenyl-4-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}butanamide |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C26 H31 N5 O2 |
| Smiles: | CCN(C(CCC(N1CCC(CC1)Cc1nncn1c1ccccc1)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0292 |
| logD: | 3.0289 |
| logSw: | -3.1821 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.971 |
| InChI Key: | DYWABDRHODAVDY-UHFFFAOYSA-N |