7-(3,4-dimethoxyphenyl)-4-[4-(methylsulfanyl)phenyl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Chemical Structure Depiction of
7-(3,4-dimethoxyphenyl)-4-[4-(methylsulfanyl)phenyl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
7-(3,4-dimethoxyphenyl)-4-[4-(methylsulfanyl)phenyl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Compound characteristics
| Compound ID: | C276-1186 |
| Compound Name: | 7-(3,4-dimethoxyphenyl)-4-[4-(methylsulfanyl)phenyl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione |
| Molecular Weight: | 423.53 |
| Molecular Formula: | C24 H25 N O4 S |
| Smiles: | COc1ccc(cc1OC)C1CC2=C(C(CC(N2)=O)c2ccc(cc2)SC)C(C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7742 |
| logD: | 2.5109 |
| logSw: | -4.1136 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.996 |
| InChI Key: | KHSWXJNFRHQXBI-UHFFFAOYSA-N |