3-(4-ethylbenzene-1-sulfonyl)-6,7-dimethoxy-1-propylquinolin-4(1H)-one
Chemical Structure Depiction of
3-(4-ethylbenzene-1-sulfonyl)-6,7-dimethoxy-1-propylquinolin-4(1H)-one
3-(4-ethylbenzene-1-sulfonyl)-6,7-dimethoxy-1-propylquinolin-4(1H)-one
Compound characteristics
| Compound ID: | C682-1429 |
| Compound Name: | 3-(4-ethylbenzene-1-sulfonyl)-6,7-dimethoxy-1-propylquinolin-4(1H)-one |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C22 H25 N O5 S |
| Smiles: | CCCN1C=C(C(c2cc(c(cc12)OC)OC)=O)S(c1ccc(CC)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0207 |
| logD: | 4.0207 |
| logSw: | -4.1136 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.574 |
| InChI Key: | GTUPEDYCGJAJJY-UHFFFAOYSA-N |