3-{[4-fluoro-4-(pyrrolidine-1-carbonyl)piperidin-1-yl]methyl}benzonitrile
Chemical Structure Depiction of
3-{[4-fluoro-4-(pyrrolidine-1-carbonyl)piperidin-1-yl]methyl}benzonitrile
3-{[4-fluoro-4-(pyrrolidine-1-carbonyl)piperidin-1-yl]methyl}benzonitrile
Compound characteristics
Compound ID: | T502-1381 |
Compound Name: | 3-{[4-fluoro-4-(pyrrolidine-1-carbonyl)piperidin-1-yl]methyl}benzonitrile |
Molecular Weight: | 315.39 |
Molecular Formula: | C18 H22 F N3 O |
Smiles: | C1CCN(C1)C(C1(CCN(CC1)Cc1cccc(C#N)c1)F)=O |
Stereo: | ACHIRAL |
logP: | 2.1632 |
logD: | 1.0273 |
logSw: | -2.4558 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 38.042 |
InChI Key: | NGQGMPYUDXYFPD-UHFFFAOYSA-N |