6-(azepane-1-sulfonyl)-N-[2-(4-chlorophenyl)ethyl]-2-(pyridin-3-yl)quinoline-4-carboxamide
Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-N-[2-(4-chlorophenyl)ethyl]-2-(pyridin-3-yl)quinoline-4-carboxamide
6-(azepane-1-sulfonyl)-N-[2-(4-chlorophenyl)ethyl]-2-(pyridin-3-yl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-1385 |
| Compound Name: | 6-(azepane-1-sulfonyl)-N-[2-(4-chlorophenyl)ethyl]-2-(pyridin-3-yl)quinoline-4-carboxamide |
| Molecular Weight: | 549.09 |
| Molecular Formula: | C29 H29 Cl N4 O3 S |
| Smiles: | C1CCCN(CC1)S(c1ccc2c(c1)c(cc(c1cccnc1)n2)C(NCCc1ccc(cc1)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4161 |
| logD: | 5.4154 |
| logSw: | -5.984 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.112 |
| InChI Key: | VTGJYQYEUWBFDI-UHFFFAOYSA-N |