3-(benzenesulfonyl)-6,7-difluoro-1-[(3-methylphenyl)methyl]quinolin-4(1H)-one
Chemical Structure Depiction of
3-(benzenesulfonyl)-6,7-difluoro-1-[(3-methylphenyl)methyl]quinolin-4(1H)-one
3-(benzenesulfonyl)-6,7-difluoro-1-[(3-methylphenyl)methyl]quinolin-4(1H)-one
Compound characteristics
| Compound ID: | C682-1287 |
| Compound Name: | 3-(benzenesulfonyl)-6,7-difluoro-1-[(3-methylphenyl)methyl]quinolin-4(1H)-one |
| Molecular Weight: | 425.45 |
| Molecular Formula: | C23 H17 F2 N O3 S |
| Smiles: | Cc1cccc(CN2C=C(C(c3cc(c(cc23)F)F)=O)S(c2ccccc2)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.4841 |
| logD: | 4.4841 |
| logSw: | -4.4572 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.063 |
| InChI Key: | PKYILCVGPGDJHW-UHFFFAOYSA-N |