5-(1-benzoylpiperidin-4-yl)-4-ethyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-(1-benzoylpiperidin-4-yl)-4-ethyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
5-(1-benzoylpiperidin-4-yl)-4-ethyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S559-0205 |
| Compound Name: | 5-(1-benzoylpiperidin-4-yl)-4-ethyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 314.39 |
| Molecular Formula: | C17 H22 N4 O2 |
| Smiles: | CCN1C(C2CCN(CC2)C(c2ccccc2)=O)=NN(C)C1=O |
| Stereo: | ACHIRAL |
| logP: | 1.9024 |
| logD: | 1.9016 |
| logSw: | -1.8397 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.741 |
| InChI Key: | UGQLBBQQEISURV-UHFFFAOYSA-N |