4-{2-[2-(4-phenyl-1H-1,2,3-triazol-1-yl)ethyl]piperidine-1-carbonyl}benzonitrile
Chemical Structure Depiction of
4-{2-[2-(4-phenyl-1H-1,2,3-triazol-1-yl)ethyl]piperidine-1-carbonyl}benzonitrile
4-{2-[2-(4-phenyl-1H-1,2,3-triazol-1-yl)ethyl]piperidine-1-carbonyl}benzonitrile
Compound characteristics
| Compound ID: | T505-0044 |
| Compound Name: | 4-{2-[2-(4-phenyl-1H-1,2,3-triazol-1-yl)ethyl]piperidine-1-carbonyl}benzonitrile |
| Molecular Weight: | 385.47 |
| Molecular Formula: | C23 H23 N5 O |
| Smiles: | C1CCN(C(C1)CCn1cc(c2ccccc2)nn1)C(c1ccc(C#N)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6661 |
| logD: | 3.6661 |
| logSw: | -3.7257 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 59.809 |
| InChI Key: | ACDDFFCYCOWIIC-OAQYLSRUSA-N |