N-[3-(cyclohexylsulfanyl)propyl]-2-(3,4-dimethylanilino)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[3-(cyclohexylsulfanyl)propyl]-2-(3,4-dimethylanilino)quinoline-4-carboxamide
N-[3-(cyclohexylsulfanyl)propyl]-2-(3,4-dimethylanilino)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-4517 |
| Compound Name: | N-[3-(cyclohexylsulfanyl)propyl]-2-(3,4-dimethylanilino)quinoline-4-carboxamide |
| Molecular Weight: | 447.64 |
| Molecular Formula: | C27 H33 N3 O S |
| Smiles: | Cc1ccc(cc1C)Nc1cc(C(NCCCSC2CCCCC2)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 7.368 |
| logD: | 7.3657 |
| logSw: | -5.7244 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.496 |
| InChI Key: | PDDLDSXWTOCRSP-UHFFFAOYSA-N |