3-(4-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}piperidine-1-carbonyl)benzonitrile
Chemical Structure Depiction of
3-(4-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}piperidine-1-carbonyl)benzonitrile
3-(4-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}piperidine-1-carbonyl)benzonitrile
Compound characteristics
| Compound ID: | S690-0606 |
| Compound Name: | 3-(4-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}piperidine-1-carbonyl)benzonitrile |
| Molecular Weight: | 401.51 |
| Molecular Formula: | C25 H27 N3 O2 |
| Smiles: | C1CCN(C1)C(c1ccc(CC2CCN(CC2)C(c2cccc(C#N)c2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2347 |
| logD: | 3.2347 |
| logSw: | -3.2664 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.686 |
| InChI Key: | MWDYGHMUNNSOFE-UHFFFAOYSA-N |