3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-oxo-N-[3-(trifluoromethyl)phenyl]-1,4-dihydroquinoline-6-sulfonamide
Chemical Structure Depiction of
3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-oxo-N-[3-(trifluoromethyl)phenyl]-1,4-dihydroquinoline-6-sulfonamide
3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-oxo-N-[3-(trifluoromethyl)phenyl]-1,4-dihydroquinoline-6-sulfonamide
Compound characteristics
| Compound ID: | K788-0972 |
| Compound Name: | 3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-oxo-N-[3-(trifluoromethyl)phenyl]-1,4-dihydroquinoline-6-sulfonamide |
| Molecular Weight: | 586.59 |
| Molecular Formula: | C28 H25 F3 N4 O5 S |
| Smiles: | COc1ccccc1N1CCN(CC1)C(C1=CNc2ccc(cc2C1=O)S(Nc1cccc(c1)C(F)(F)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4483 |
| logD: | 2.877 |
| logSw: | -4.2813 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.245 |
| InChI Key: | KGKHMVALLDGWRB-UHFFFAOYSA-N |