3-[4-({4-[(pyrrolidin-1-yl)methyl]phenyl}methyl)piperidine-1-carbonyl]benzonitrile
Chemical Structure Depiction of
3-[4-({4-[(pyrrolidin-1-yl)methyl]phenyl}methyl)piperidine-1-carbonyl]benzonitrile
3-[4-({4-[(pyrrolidin-1-yl)methyl]phenyl}methyl)piperidine-1-carbonyl]benzonitrile
Compound characteristics
Compound ID: | S722-0351 |
Compound Name: | 3-[4-({4-[(pyrrolidin-1-yl)methyl]phenyl}methyl)piperidine-1-carbonyl]benzonitrile |
Molecular Weight: | 387.52 |
Molecular Formula: | C25 H29 N3 O |
Smiles: | C1CCN(C1)Cc1ccc(CC2CCN(CC2)C(c2cccc(C#N)c2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.6785 |
logD: | 1.0586 |
logSw: | -4.0964 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 37.77 |
InChI Key: | CPRTZJZVMXRUTO-UHFFFAOYSA-N |