N-{3-[benzyl(butyl)amino]propyl}-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
Chemical Structure Depiction of
N-{3-[benzyl(butyl)amino]propyl}-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
N-{3-[benzyl(butyl)amino]propyl}-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | C387-1502 |
| Compound Name: | N-{3-[benzyl(butyl)amino]propyl}-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide |
| Molecular Weight: | 512.72 |
| Molecular Formula: | C31 H36 N4 O S |
| Smiles: | CCCCN(CCCNC(c1cc(Nc2cccc(c2)SC)nc2ccccc12)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 7.1374 |
| logD: | 5.5749 |
| logSw: | -5.7993 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.244 |
| InChI Key: | SQAZFXFEECECMQ-UHFFFAOYSA-N |