7-(azepan-1-yl)-3-(benzenesulfonyl)-1-ethyl-6-fluoroquinolin-4(1H)-one
Chemical Structure Depiction of
7-(azepan-1-yl)-3-(benzenesulfonyl)-1-ethyl-6-fluoroquinolin-4(1H)-one
7-(azepan-1-yl)-3-(benzenesulfonyl)-1-ethyl-6-fluoroquinolin-4(1H)-one
Compound characteristics
| Compound ID: | E599-0029 |
| Compound Name: | 7-(azepan-1-yl)-3-(benzenesulfonyl)-1-ethyl-6-fluoroquinolin-4(1H)-one |
| Molecular Weight: | 428.52 |
| Molecular Formula: | C23 H25 F N2 O3 S |
| Smiles: | CCN1C=C(C(c2cc(c(cc12)N1CCCCCC1)F)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0231 |
| logD: | 4.0231 |
| logSw: | -4.0691 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.542 |
| InChI Key: | SPJLOPFVMYCPAK-UHFFFAOYSA-N |