7-(azepan-1-yl)-3-(benzenesulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one
Chemical Structure Depiction of
7-(azepan-1-yl)-3-(benzenesulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one
7-(azepan-1-yl)-3-(benzenesulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one
Compound characteristics
| Compound ID: | E599-0016 |
| Compound Name: | 7-(azepan-1-yl)-3-(benzenesulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one |
| Molecular Weight: | 414.5 |
| Molecular Formula: | C22 H23 F N2 O3 S |
| Smiles: | CN1C=C(C(c2cc(c(cc12)N1CCCCCC1)F)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3965 |
| logD: | 3.3965 |
| logSw: | -4.0656 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.533 |
| InChI Key: | GXOKJABDSHZWTB-UHFFFAOYSA-N |