N-[3-(cyclohexylsulfanyl)propyl]-2-(2-methoxyanilino)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[3-(cyclohexylsulfanyl)propyl]-2-(2-methoxyanilino)quinoline-4-carboxamide
N-[3-(cyclohexylsulfanyl)propyl]-2-(2-methoxyanilino)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-2840 |
| Compound Name: | N-[3-(cyclohexylsulfanyl)propyl]-2-(2-methoxyanilino)quinoline-4-carboxamide |
| Molecular Weight: | 449.61 |
| Molecular Formula: | C26 H31 N3 O2 S |
| Smiles: | COc1ccccc1Nc1cc(C(NCCCSC2CCCCC2)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 6.407 |
| logD: | 6.3936 |
| logSw: | -5.8033 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.428 |
| InChI Key: | JEPDEWNERZQQCZ-UHFFFAOYSA-N |