3-{[({4-[(1-acetylpiperidin-4-yl)methyl]phenyl}methyl)(cyclopropyl)amino]methyl}benzonitrile
Chemical Structure Depiction of
3-{[({4-[(1-acetylpiperidin-4-yl)methyl]phenyl}methyl)(cyclopropyl)amino]methyl}benzonitrile
3-{[({4-[(1-acetylpiperidin-4-yl)methyl]phenyl}methyl)(cyclopropyl)amino]methyl}benzonitrile
Compound characteristics
| Compound ID: | S722-1944 |
| Compound Name: | 3-{[({4-[(1-acetylpiperidin-4-yl)methyl]phenyl}methyl)(cyclopropyl)amino]methyl}benzonitrile |
| Molecular Weight: | 401.55 |
| Molecular Formula: | C26 H31 N3 O |
| Smiles: | CC(N1CCC(CC1)Cc1ccc(CN(Cc2cccc(C#N)c2)C2CC2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3544 |
| logD: | 4.336 |
| logSw: | -4.4034 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.319 |
| InChI Key: | VFSVUMQXQLBEMQ-UHFFFAOYSA-N |