2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-5-(4-methylpiperazine-1-carbonyl)-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide
Chemical Structure Depiction of
2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-5-(4-methylpiperazine-1-carbonyl)-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide
2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-5-(4-methylpiperazine-1-carbonyl)-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | K659-0377 |
| Compound Name: | 2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-5-(4-methylpiperazine-1-carbonyl)-N-[3-(trifluoromethyl)phenyl]benzene-1-sulfonamide |
| Molecular Weight: | 606.66 |
| Molecular Formula: | C29 H33 F3 N4 O5 S |
| Smiles: | CN1CCN(CC1)C(c1ccc(c(c1)S(Nc1cccc(c1)C(F)(F)F)(=O)=O)NCCc1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4482 |
| logD: | 1.6996 |
| logSw: | -3.9842 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.652 |
| InChI Key: | PAJFYFXYZCRBHX-UHFFFAOYSA-N |