N-{3-[methyl(phenyl)amino]propyl}-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
Chemical Structure Depiction of
N-{3-[methyl(phenyl)amino]propyl}-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
N-{3-[methyl(phenyl)amino]propyl}-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-3435 |
| Compound Name: | N-{3-[methyl(phenyl)amino]propyl}-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide |
| Molecular Weight: | 456.61 |
| Molecular Formula: | C27 H28 N4 O S |
| Smiles: | CN(CCCNC(c1cc(Nc2cccc(c2)SC)nc2ccccc12)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6728 |
| logD: | 5.6679 |
| logSw: | -5.6006 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.508 |
| InChI Key: | GZSPWIMQJWPPIW-UHFFFAOYSA-N |