N-(4-{N-[3-(trifluoromethyl)phenyl]-beta-alanyl}phenyl)methanesulfonamide
Chemical Structure Depiction of
N-(4-{N-[3-(trifluoromethyl)phenyl]-beta-alanyl}phenyl)methanesulfonamide
N-(4-{N-[3-(trifluoromethyl)phenyl]-beta-alanyl}phenyl)methanesulfonamide
Compound characteristics
| Compound ID: | 8017-4885 |
| Compound Name: | N-(4-{N-[3-(trifluoromethyl)phenyl]-beta-alanyl}phenyl)methanesulfonamide |
| Molecular Weight: | 386.39 |
| Molecular Formula: | C17 H17 F3 N2 O3 S |
| Smiles: | CS(Nc1ccc(cc1)C(CCNc1cccc(c1)C(F)(F)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1037 |
| logD: | 2.7755 |
| logSw: | -3.7324 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.429 |
| InChI Key: | IAEJFJWJVYLYCO-UHFFFAOYSA-N |