2-methoxyethyl 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
2-methoxyethyl 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
2-methoxyethyl 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: | 4323-7117 |
| Compound Name: | 2-methoxyethyl 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: | 491.56 |
| Molecular Formula: | C27 H25 N O6 S |
| Smiles: | CC1=C(C(C2=COc3ccccc3C2=O)C2=C(CC(CC2=O)c2cccs2)N1)C(=O)OCCOC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3828 |
| logD: | -1.152 |
| logSw: | -3.9105 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.951 |
| InChI Key: | JDAIQDXRMSUUME-UHFFFAOYSA-N |