3-(benzenesulfonyl)-1-[(2,5-dimethylphenyl)methyl]-6-fluoroquinolin-4(1H)-one
Chemical Structure Depiction of
3-(benzenesulfonyl)-1-[(2,5-dimethylphenyl)methyl]-6-fluoroquinolin-4(1H)-one
3-(benzenesulfonyl)-1-[(2,5-dimethylphenyl)methyl]-6-fluoroquinolin-4(1H)-one
Compound characteristics
| Compound ID: | C682-1083 |
| Compound Name: | 3-(benzenesulfonyl)-1-[(2,5-dimethylphenyl)methyl]-6-fluoroquinolin-4(1H)-one |
| Molecular Weight: | 421.49 |
| Molecular Formula: | C24 H20 F N O3 S |
| Smiles: | Cc1ccc(C)c(CN2C=C(C(c3cc(ccc23)F)=O)S(c2ccccc2)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.1317 |
| logD: | 5.1317 |
| logSw: | -4.9918 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.063 |
| InChI Key: | MKULYVMERNUSNV-UHFFFAOYSA-N |