7-(azepan-1-yl)-6-fluoro-3-(3-methylbenzene-1-sulfonyl)-1-propylquinolin-4(1H)-one
Chemical Structure Depiction of
7-(azepan-1-yl)-6-fluoro-3-(3-methylbenzene-1-sulfonyl)-1-propylquinolin-4(1H)-one
7-(azepan-1-yl)-6-fluoro-3-(3-methylbenzene-1-sulfonyl)-1-propylquinolin-4(1H)-one
Compound characteristics
| Compound ID: | E599-0562 |
| Compound Name: | 7-(azepan-1-yl)-6-fluoro-3-(3-methylbenzene-1-sulfonyl)-1-propylquinolin-4(1H)-one |
| Molecular Weight: | 456.58 |
| Molecular Formula: | C25 H29 F N2 O3 S |
| Smiles: | CCCN1C=C(C(c2cc(c(cc12)N1CCCCCC1)F)=O)S(c1cccc(C)c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9762 |
| logD: | 4.9762 |
| logSw: | -4.6947 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.796 |
| InChI Key: | HFYLNKVIPBFJOX-UHFFFAOYSA-N |