ethyl 2-methyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
ethyl 2-methyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
ethyl 2-methyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 4323-7101 |
| Compound Name: | ethyl 2-methyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 461.54 |
| Molecular Formula: | C26 H23 N O5 S |
| Smiles: | CCOC(C1C(C2=COc3ccccc3C2=O)C2=C(CC(CC2=O)c2cccs2)NC=1C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.307 |
| logD: | -0.2279 |
| logSw: | -4.412 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.315 |
| InChI Key: | BSWUDWZNHPCJCI-UHFFFAOYSA-N |