3-(2,4-dimethylbenzene-1-sulfonyl)-7-(3,5-dimethylpiperidin-1-yl)-1-ethyl-6-fluoroquinolin-4(1H)-one
Chemical Structure Depiction of
3-(2,4-dimethylbenzene-1-sulfonyl)-7-(3,5-dimethylpiperidin-1-yl)-1-ethyl-6-fluoroquinolin-4(1H)-one
3-(2,4-dimethylbenzene-1-sulfonyl)-7-(3,5-dimethylpiperidin-1-yl)-1-ethyl-6-fluoroquinolin-4(1H)-one
Compound characteristics
Compound ID: | E599-0347 |
Compound Name: | 3-(2,4-dimethylbenzene-1-sulfonyl)-7-(3,5-dimethylpiperidin-1-yl)-1-ethyl-6-fluoroquinolin-4(1H)-one |
Molecular Weight: | 470.61 |
Molecular Formula: | C26 H31 F N2 O3 S |
Smiles: | CCN1C=C(C(c2cc(c(cc12)N1CC(C)CC(C)C1)F)=O)S(c1ccc(C)cc1C)(=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.2048 |
logD: | 5.2048 |
logSw: | -4.9921 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 48.078 |
InChI Key: | OZNIYVRDVFUKHY-UHFFFAOYSA-N |