1-[(2-chloro-6-fluorophenyl)methanesulfonyl]-N-[4-(cyanomethyl)phenyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-[(2-chloro-6-fluorophenyl)methanesulfonyl]-N-[4-(cyanomethyl)phenyl]piperidine-4-carboxamide
1-[(2-chloro-6-fluorophenyl)methanesulfonyl]-N-[4-(cyanomethyl)phenyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | D356-2227 |
| Compound Name: | 1-[(2-chloro-6-fluorophenyl)methanesulfonyl]-N-[4-(cyanomethyl)phenyl]piperidine-4-carboxamide |
| Molecular Weight: | 449.93 |
| Molecular Formula: | C21 H21 Cl F N3 O3 S |
| Smiles: | C1CN(CCC1C(Nc1ccc(CC#N)cc1)=O)S(Cc1c(cccc1[Cl])F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6828 |
| logD: | 2.6828 |
| logSw: | -3.5214 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.427 |
| InChI Key: | SCMPRCUBXSENSB-UHFFFAOYSA-N |