5-{1-[(4-fluorophenoxy)acetyl]piperidin-3-yl}-2-methyl-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-{1-[(4-fluorophenoxy)acetyl]piperidin-3-yl}-2-methyl-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
5-{1-[(4-fluorophenoxy)acetyl]piperidin-3-yl}-2-methyl-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | P940-4587 |
| Compound Name: | 5-{1-[(4-fluorophenoxy)acetyl]piperidin-3-yl}-2-methyl-4-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 410.45 |
| Molecular Formula: | C22 H23 F N4 O3 |
| Smiles: | CN1C(N(C(C2CCCN(C2)C(COc2ccc(cc2)F)=O)=N1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.59 |
| logD: | 2.59 |
| logSw: | -2.52 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.039 |
| InChI Key: | PKAOZNXXGKJRIO-INIZCTEOSA-N |