3-(benzenesulfonyl)-6,7-difluoro-1-[(4-methylphenyl)methyl]quinolin-4(1H)-one
Chemical Structure Depiction of
3-(benzenesulfonyl)-6,7-difluoro-1-[(4-methylphenyl)methyl]quinolin-4(1H)-one
3-(benzenesulfonyl)-6,7-difluoro-1-[(4-methylphenyl)methyl]quinolin-4(1H)-one
Compound characteristics
Compound ID: | C682-1286 |
Compound Name: | 3-(benzenesulfonyl)-6,7-difluoro-1-[(4-methylphenyl)methyl]quinolin-4(1H)-one |
Molecular Weight: | 425.45 |
Molecular Formula: | C23 H17 F2 N O3 S |
Smiles: | Cc1ccc(CN2C=C(C(c3cc(c(cc23)F)F)=O)S(c2ccccc2)(=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 4.2609 |
logD: | 4.2609 |
logSw: | -4.3884 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 45.063 |
InChI Key: | MPMUQWQSCZLIAN-UHFFFAOYSA-N |