5-(1-benzoylpiperidin-4-yl)-2-methyl-4-(2-phenylethyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-(1-benzoylpiperidin-4-yl)-2-methyl-4-(2-phenylethyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
5-(1-benzoylpiperidin-4-yl)-2-methyl-4-(2-phenylethyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S559-1185 |
| Compound Name: | 5-(1-benzoylpiperidin-4-yl)-2-methyl-4-(2-phenylethyl)-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 390.48 |
| Molecular Formula: | C23 H26 N4 O2 |
| Smiles: | CN1C(N(CCc2ccccc2)C(C2CCN(CC2)C(c2ccccc2)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3036 |
| logD: | 3.3035 |
| logSw: | -3.3107 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.723 |
| InChI Key: | TUHRAENJDMGSKI-UHFFFAOYSA-N |