6-fluoro-3-(3-methylbenzene-1-sulfonyl)-1-[(4-methylphenyl)methyl]-7-(pyrrolidin-1-yl)quinolin-4(1H)-one
Chemical Structure Depiction of
6-fluoro-3-(3-methylbenzene-1-sulfonyl)-1-[(4-methylphenyl)methyl]-7-(pyrrolidin-1-yl)quinolin-4(1H)-one
6-fluoro-3-(3-methylbenzene-1-sulfonyl)-1-[(4-methylphenyl)methyl]-7-(pyrrolidin-1-yl)quinolin-4(1H)-one
Compound characteristics
Compound ID: | E599-0584 |
Compound Name: | 6-fluoro-3-(3-methylbenzene-1-sulfonyl)-1-[(4-methylphenyl)methyl]-7-(pyrrolidin-1-yl)quinolin-4(1H)-one |
Molecular Weight: | 490.6 |
Molecular Formula: | C28 H27 F N2 O3 S |
Smiles: | Cc1ccc(CN2C=C(C(c3cc(c(cc23)N2CCCC2)F)=O)S(c2cccc(C)c2)(=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 5.1095 |
logD: | 5.1095 |
logSw: | -4.9782 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 48.581 |
InChI Key: | SBKCESCUVYZSPA-UHFFFAOYSA-N |