6-(azepane-1-sulfonyl)-N-[2-(4-methylphenyl)ethyl]-2-(pyridin-3-yl)quinoline-4-carboxamide
Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-N-[2-(4-methylphenyl)ethyl]-2-(pyridin-3-yl)quinoline-4-carboxamide
6-(azepane-1-sulfonyl)-N-[2-(4-methylphenyl)ethyl]-2-(pyridin-3-yl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-1387 |
| Compound Name: | 6-(azepane-1-sulfonyl)-N-[2-(4-methylphenyl)ethyl]-2-(pyridin-3-yl)quinoline-4-carboxamide |
| Molecular Weight: | 528.67 |
| Molecular Formula: | C30 H32 N4 O3 S |
| Smiles: | Cc1ccc(CCNC(c2cc(c3cccnc3)nc3ccc(cc23)S(N2CCCCCC2)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2448 |
| logD: | 5.2441 |
| logSw: | -4.793 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.112 |
| InChI Key: | GBVIVRHTXJHMFG-UHFFFAOYSA-N |