N-[3-(butylsulfanyl)propyl]-2-(4-ethoxyanilino)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[3-(butylsulfanyl)propyl]-2-(4-ethoxyanilino)quinoline-4-carboxamide
N-[3-(butylsulfanyl)propyl]-2-(4-ethoxyanilino)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-5400 |
| Compound Name: | N-[3-(butylsulfanyl)propyl]-2-(4-ethoxyanilino)quinoline-4-carboxamide |
| Molecular Weight: | 437.6 |
| Molecular Formula: | C25 H31 N3 O2 S |
| Smiles: | CCCCSCCCNC(c1cc(Nc2ccc(cc2)OCC)nc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1982 |
| logD: | 6.1978 |
| logSw: | -5.5989 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.699 |
| InChI Key: | BQAWPICIEGLVOC-UHFFFAOYSA-N |