N-[3-(azepan-1-yl)propyl]-2-(4-methoxyanilino)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-2-(4-methoxyanilino)quinoline-4-carboxamide
N-[3-(azepan-1-yl)propyl]-2-(4-methoxyanilino)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-5876 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-2-(4-methoxyanilino)quinoline-4-carboxamide |
| Molecular Weight: | 432.57 |
| Molecular Formula: | C26 H32 N4 O2 |
| Smiles: | COc1ccc(cc1)Nc1cc(C(NCCCN2CCCCCC2)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.1442 |
| logD: | 2.5735 |
| logSw: | -5.1032 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.161 |
| InChI Key: | YBBRFJSCRZUPLW-UHFFFAOYSA-N |