N-(4-bromo-2-fluorophenyl)-1-[(3-methylphenyl)methanesulfonyl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-fluorophenyl)-1-[(3-methylphenyl)methanesulfonyl]piperidine-4-carboxamide
N-(4-bromo-2-fluorophenyl)-1-[(3-methylphenyl)methanesulfonyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | D356-0862 |
| Compound Name: | N-(4-bromo-2-fluorophenyl)-1-[(3-methylphenyl)methanesulfonyl]piperidine-4-carboxamide |
| Molecular Weight: | 469.37 |
| Molecular Formula: | C20 H22 Br F N2 O3 S |
| Smiles: | Cc1cccc(CS(N2CCC(CC2)C(Nc2ccc(cc2F)[Br])=O)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.2489 |
| logD: | 4.2069 |
| logSw: | -4.2211 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.237 |
| InChI Key: | YLDWAUFWLKIPKR-UHFFFAOYSA-N |