5-(1-acetylpiperidin-3-yl)-4-benzyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-(1-acetylpiperidin-3-yl)-4-benzyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
5-(1-acetylpiperidin-3-yl)-4-benzyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | P940-4092 |
| Compound Name: | 5-(1-acetylpiperidin-3-yl)-4-benzyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 314.39 |
| Molecular Formula: | C17 H22 N4 O2 |
| Smiles: | CC(N1CCCC(C1)C1=NN(C)C(N1Cc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0586 |
| logD: | 2.0586 |
| logSw: | -2.1077 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.418 |
| InChI Key: | CLIMTTXYNBURAB-HNNXBMFYSA-N |