1-butyl-3-(4-chlorobenzene-1-sulfonyl)-6-ethylquinolin-4(1H)-one
Chemical Structure Depiction of
1-butyl-3-(4-chlorobenzene-1-sulfonyl)-6-ethylquinolin-4(1H)-one
1-butyl-3-(4-chlorobenzene-1-sulfonyl)-6-ethylquinolin-4(1H)-one
Compound characteristics
| Compound ID: | C682-1578 |
| Compound Name: | 1-butyl-3-(4-chlorobenzene-1-sulfonyl)-6-ethylquinolin-4(1H)-one |
| Molecular Weight: | 403.93 |
| Molecular Formula: | C21 H22 Cl N O3 S |
| Smiles: | CCCCN1C=C(C(c2cc(CC)ccc12)=O)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1228 |
| logD: | 5.1228 |
| logSw: | -5.3501 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.313 |
| InChI Key: | MCUSTIVALRQDOA-UHFFFAOYSA-N |