1-butyl-6,7-difluoro-3-(4-methylbenzene-1-sulfonyl)quinolin-4(1H)-one
Chemical Structure Depiction of
1-butyl-6,7-difluoro-3-(4-methylbenzene-1-sulfonyl)quinolin-4(1H)-one
1-butyl-6,7-difluoro-3-(4-methylbenzene-1-sulfonyl)quinolin-4(1H)-one
Compound characteristics
| Compound ID: | C682-1293 |
| Compound Name: | 1-butyl-6,7-difluoro-3-(4-methylbenzene-1-sulfonyl)quinolin-4(1H)-one |
| Molecular Weight: | 391.44 |
| Molecular Formula: | C20 H19 F2 N O3 S |
| Smiles: | CCCCN1C=C(C(c2cc(c(cc12)F)F)=O)S(c1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3147 |
| logD: | 4.3147 |
| logSw: | -4.1959 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.313 |
| InChI Key: | AOAYSMIHHZJQNY-UHFFFAOYSA-N |