6-methyl 3-propyl 4-(6-chloro-4-oxo-4H-1-benzopyran-3-yl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Chemical Structure Depiction of
6-methyl 3-propyl 4-(6-chloro-4-oxo-4H-1-benzopyran-3-yl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
6-methyl 3-propyl 4-(6-chloro-4-oxo-4H-1-benzopyran-3-yl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Compound characteristics
| Compound ID: | C142-0153 |
| Compound Name: | 6-methyl 3-propyl 4-(6-chloro-4-oxo-4H-1-benzopyran-3-yl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate |
| Molecular Weight: | 499.95 |
| Molecular Formula: | C26 H26 Cl N O7 |
| Smiles: | CCCOC(C1C(C2=COc3ccc(cc3C2=O)[Cl])C2=C(CC(C)C(C2=O)C(=O)OC)NC=1C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2551 |
| logD: | 0.2321 |
| logSw: | -4.5901 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.935 |
| InChI Key: | OOIRTAPAFWUPGL-UHFFFAOYSA-N |