5-(1-benzoylpiperidin-3-yl)-2-methyl-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-(1-benzoylpiperidin-3-yl)-2-methyl-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
5-(1-benzoylpiperidin-3-yl)-2-methyl-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | P940-4527 |
| Compound Name: | 5-(1-benzoylpiperidin-3-yl)-2-methyl-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 362.43 |
| Molecular Formula: | C21 H22 N4 O2 |
| Smiles: | CN1C(N(C(C2CCCN(C2)C(c2ccccc2)=O)=N1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6434 |
| logD: | 2.6433 |
| logSw: | -2.6127 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.067 |
| InChI Key: | JLSOZKODHGEHGU-KRWDZBQOSA-N |