2-methoxyethyl 4-(6-chloro-4-oxo-4H-1-benzopyran-3-yl)-7-(3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
2-methoxyethyl 4-(6-chloro-4-oxo-4H-1-benzopyran-3-yl)-7-(3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
2-methoxyethyl 4-(6-chloro-4-oxo-4H-1-benzopyran-3-yl)-7-(3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 8014-3742 |
| Compound Name: | 2-methoxyethyl 4-(6-chloro-4-oxo-4H-1-benzopyran-3-yl)-7-(3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 550.01 |
| Molecular Formula: | C30 H28 Cl N O7 |
| Smiles: | CC1=C(C(C2=COc3ccc(cc3C2=O)[Cl])C2=C(CC(CC2=O)c2cccc(c2)OC)N1)C(=O)OCCOC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.378 |
| logD: | -0.2913 |
| logSw: | -4.6609 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.477 |
| InChI Key: | ZDFHIEBRZVTDSO-UHFFFAOYSA-N |