5-(4-acetylpiperazine-1-carbonyl)-2-{[(4-fluorophenyl)methyl]amino}-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide
Chemical Structure Depiction of
5-(4-acetylpiperazine-1-carbonyl)-2-{[(4-fluorophenyl)methyl]amino}-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide
5-(4-acetylpiperazine-1-carbonyl)-2-{[(4-fluorophenyl)methyl]amino}-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | K781-1482 |
| Compound Name: | 5-(4-acetylpiperazine-1-carbonyl)-2-{[(4-fluorophenyl)methyl]amino}-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide |
| Molecular Weight: | 578.59 |
| Molecular Formula: | C27 H26 F4 N4 O4 S |
| Smiles: | CC(N1CCN(CC1)C(c1ccc(c(c1)S(Nc1cccc(c1)C(F)(F)F)(=O)=O)NCc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.565 |
| logD: | 1.8164 |
| logSw: | -3.853 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.269 |
| InChI Key: | KBPYIQAOGMXISP-UHFFFAOYSA-N |