7-(azepan-1-yl)-3-(2,5-dimethylbenzene-1-sulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one
Chemical Structure Depiction of
7-(azepan-1-yl)-3-(2,5-dimethylbenzene-1-sulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one
7-(azepan-1-yl)-3-(2,5-dimethylbenzene-1-sulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one
Compound characteristics
| Compound ID: | E599-0390 |
| Compound Name: | 7-(azepan-1-yl)-3-(2,5-dimethylbenzene-1-sulfonyl)-6-fluoro-1-methylquinolin-4(1H)-one |
| Molecular Weight: | 442.55 |
| Molecular Formula: | C24 H27 F N2 O3 S |
| Smiles: | Cc1ccc(C)c(c1)S(C1=CN(C)c2cc(c(cc2C1=O)F)N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3059 |
| logD: | 4.3059 |
| logSw: | -4.3062 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.533 |
| InChI Key: | HXSBTRUMPIGGNN-UHFFFAOYSA-N |