2-methoxyethyl 7-(2-chlorophenyl)-2-methyl-4-(6-methyl-4-oxo-4H-1-benzopyran-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
2-methoxyethyl 7-(2-chlorophenyl)-2-methyl-4-(6-methyl-4-oxo-4H-1-benzopyran-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
2-methoxyethyl 7-(2-chlorophenyl)-2-methyl-4-(6-methyl-4-oxo-4H-1-benzopyran-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 5991-0328 |
| Compound Name: | 2-methoxyethyl 7-(2-chlorophenyl)-2-methyl-4-(6-methyl-4-oxo-4H-1-benzopyran-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 534.01 |
| Molecular Formula: | C30 H28 Cl N O6 |
| Smiles: | CC1=C(C(C2=COc3ccc(C)cc3C2=O)C2=C(CC(CC2=O)c2ccccc2[Cl])N1)C(=O)OCCOC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7211 |
| logD: | 0.0518 |
| logSw: | -4.8282 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.933 |
| InChI Key: | XOCLGPRHSZFPMO-UHFFFAOYSA-N |