N-[2-(azepan-1-yl)ethyl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide
N-[2-(azepan-1-yl)ethyl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K786-0637 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide |
| Molecular Weight: | 401.55 |
| Molecular Formula: | C26 H31 N3 O |
| Smiles: | Cc1ccc(cc1C)c1cc(C(NCCN2CCCCCC2)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 6.0566 |
| logD: | 5.0799 |
| logSw: | -5.4851 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.866 |
| InChI Key: | OLAFLRAGFRZNTC-UHFFFAOYSA-N |