4-phenyl-1-{4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}butan-1-one
Chemical Structure Depiction of
4-phenyl-1-{4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}butan-1-one
4-phenyl-1-{4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | S564-0391 |
| Compound Name: | 4-phenyl-1-{4-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}butan-1-one |
| Molecular Weight: | 388.51 |
| Molecular Formula: | C24 H28 N4 O |
| Smiles: | C(CC(N1CCC(CC1)Cc1nnc(c2ccccc2)[nH]1)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5446 |
| logD: | 4.5088 |
| logSw: | -4.4683 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.863 |
| InChI Key: | AJTVFCOMQRAHAY-UHFFFAOYSA-N |