N-[4-(cyanomethyl)phenyl]-1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[4-(cyanomethyl)phenyl]-1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-carboxamide
N-[4-(cyanomethyl)phenyl]-1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | D356-2021 |
| Compound Name: | N-[4-(cyanomethyl)phenyl]-1-[(4-fluorophenyl)methanesulfonyl]piperidine-4-carboxamide |
| Molecular Weight: | 415.49 |
| Molecular Formula: | C21 H22 F N3 O3 S |
| Smiles: | C1CN(CCC1C(Nc1ccc(CC#N)cc1)=O)S(Cc1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8073 |
| logD: | 1.8073 |
| logSw: | -2.4732 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.427 |
| InChI Key: | AELOVCZUENNAJD-UHFFFAOYSA-N |