2-phenoxy-1-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-phenoxy-1-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}ethan-1-one
2-phenoxy-1-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S517-0242 |
| Compound Name: | 2-phenoxy-1-{4-[(4-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}ethan-1-one |
| Molecular Weight: | 376.46 |
| Molecular Formula: | C22 H24 N4 O2 |
| Smiles: | C1CN(CCC1Cc1nncn1c1ccccc1)C(COc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.652 |
| logD: | 2.6518 |
| logSw: | -2.7893 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.378 |
| InChI Key: | SUNNGVXYEMVSNV-UHFFFAOYSA-N |