1-[(2,5-dimethylphenyl)methyl]-3-(4-ethoxybenzene-1-sulfonyl)-6-fluoroquinolin-4(1H)-one
Chemical Structure Depiction of
1-[(2,5-dimethylphenyl)methyl]-3-(4-ethoxybenzene-1-sulfonyl)-6-fluoroquinolin-4(1H)-one
1-[(2,5-dimethylphenyl)methyl]-3-(4-ethoxybenzene-1-sulfonyl)-6-fluoroquinolin-4(1H)-one
Compound characteristics
Compound ID: | C682-1224 |
Compound Name: | 1-[(2,5-dimethylphenyl)methyl]-3-(4-ethoxybenzene-1-sulfonyl)-6-fluoroquinolin-4(1H)-one |
Molecular Weight: | 465.54 |
Molecular Formula: | C26 H24 F N O4 S |
Smiles: | CCOc1ccc(cc1)S(C1=CN(Cc2cc(C)ccc2C)c2ccc(cc2C1=O)F)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.6857 |
logD: | 5.6857 |
logSw: | -5.4661 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 52.187 |
InChI Key: | KXRKFDHEMYOMNY-UHFFFAOYSA-N |