1-butyl-3-(4-ethoxybenzene-1-sulfonyl)-6,7-dimethoxyquinolin-4(1H)-one
Chemical Structure Depiction of
1-butyl-3-(4-ethoxybenzene-1-sulfonyl)-6,7-dimethoxyquinolin-4(1H)-one
1-butyl-3-(4-ethoxybenzene-1-sulfonyl)-6,7-dimethoxyquinolin-4(1H)-one
Compound characteristics
| Compound ID: | C682-1456 |
| Compound Name: | 1-butyl-3-(4-ethoxybenzene-1-sulfonyl)-6,7-dimethoxyquinolin-4(1H)-one |
| Molecular Weight: | 445.53 |
| Molecular Formula: | C23 H27 N O6 S |
| Smiles: | CCCCN1C=C(C(c2cc(c(cc12)OC)OC)=O)S(c1ccc(cc1)OCC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8884 |
| logD: | 3.8884 |
| logSw: | -3.9809 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.698 |
| InChI Key: | BNBPPUBFEVBQQP-UHFFFAOYSA-N |