2-(2-fluorophenyl)-1-{4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(2-fluorophenyl)-1-{4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}ethan-1-one
2-(2-fluorophenyl)-1-{4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S564-0388 |
| Compound Name: | 2-(2-fluorophenyl)-1-{4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}ethan-1-one |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C22 H23 F N4 O |
| Smiles: | C1CN(CCC1Cc1nnc(c2ccccc2)[nH]1)C(Cc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8885 |
| logD: | 3.8527 |
| logSw: | -4.1392 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.863 |
| InChI Key: | HLAGDGSKKIFOHO-UHFFFAOYSA-N |