N-[2-(azepan-1-yl)ethyl]-2-(2,4-dimethoxyanilino)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-2-(2,4-dimethoxyanilino)quinoline-4-carboxamide
N-[2-(azepan-1-yl)ethyl]-2-(2,4-dimethoxyanilino)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | C387-0293 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-2-(2,4-dimethoxyanilino)quinoline-4-carboxamide |
| Molecular Weight: | 448.56 |
| Molecular Formula: | C26 H32 N4 O3 |
| Smiles: | COc1ccc(c(c1)OC)Nc1cc(C(NCCN2CCCCCC2)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.0572 |
| logD: | 4.0804 |
| logSw: | -4.7626 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.093 |
| InChI Key: | YYEAWPUDZFIQJW-UHFFFAOYSA-N |