1-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]-2-methoxyethan-1-one
Chemical Structure Depiction of
1-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]-2-methoxyethan-1-one
1-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]-2-methoxyethan-1-one
Compound characteristics
| Compound ID: | P935-1800 |
| Compound Name: | 1-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)piperidin-1-yl]-2-methoxyethan-1-one |
| Molecular Weight: | 314.39 |
| Molecular Formula: | C17 H22 N4 O2 |
| Smiles: | COCC(N1CCCCC1c1nncn1Cc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0838 |
| logD: | 1.0838 |
| logSw: | -1.7348 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.833 |
| InChI Key: | RGDZFJKMDFRGRT-HNNXBMFYSA-N |