N-[3-(butylsulfanyl)propyl]-2-(3,4-dimethylanilino)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[3-(butylsulfanyl)propyl]-2-(3,4-dimethylanilino)quinoline-4-carboxamide
N-[3-(butylsulfanyl)propyl]-2-(3,4-dimethylanilino)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-4516 |
| Compound Name: | N-[3-(butylsulfanyl)propyl]-2-(3,4-dimethylanilino)quinoline-4-carboxamide |
| Molecular Weight: | 421.6 |
| Molecular Formula: | C25 H31 N3 O S |
| Smiles: | CCCCSCCCNC(c1cc(Nc2ccc(C)c(C)c2)nc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8167 |
| logD: | 6.8144 |
| logSw: | -5.7514 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.575 |
| InChI Key: | APGBSGTXPLVROP-UHFFFAOYSA-N |