6-(azepane-1-sulfonyl)-N-[(2-chlorophenyl)methyl]-2-(pyridin-3-yl)quinoline-4-carboxamide
Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-N-[(2-chlorophenyl)methyl]-2-(pyridin-3-yl)quinoline-4-carboxamide
6-(azepane-1-sulfonyl)-N-[(2-chlorophenyl)methyl]-2-(pyridin-3-yl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-1380 |
| Compound Name: | 6-(azepane-1-sulfonyl)-N-[(2-chlorophenyl)methyl]-2-(pyridin-3-yl)quinoline-4-carboxamide |
| Molecular Weight: | 535.06 |
| Molecular Formula: | C28 H27 Cl N4 O3 S |
| Smiles: | C1CCCN(CC1)S(c1ccc2c(c1)c(cc(c1cccnc1)n2)C(NCc1ccccc1[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6699 |
| logD: | 5.6692 |
| logSw: | -5.987 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.271 |
| InChI Key: | RERDNSXZLGEOCH-UHFFFAOYSA-N |