TL;DR: Ethyl 7-chloro-4-hydroxy-6-methoxyquinoline-3-carboxylate (CAS 1373767-56-6) is a chemical compound with molecular formula C13H12ClNO4 and molecular weight 281.04547 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 7-chloro-6-methoxy-4-oxo-1H-quinoline-3-carboxylate
Also Known As: Ethyl 7-chloro-4-hydroxy-6-methoxyquinoline-3-carboxylate, ethyl 7-chloro-6-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxylate, Ethyl 7-chloro-6-methoxy-4-oxo-1H-quinoline-3-carboxylate, Ethyl7-chloro-4-hydroxy-6-methoxyquinoline-3-carboxylate, F6782-3872
| Molecular Formula | C13H12ClNO4 |
| Molecular Weight | 281.04547 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.04547 Da |
| Heavy Atoms | 19 |
| Complexity | 409.0 |
| SMILES | CCOC(=O)C1=CNC2=CC(=C(C=C2C1=O)OC)Cl |
| InChIKey | LLIWHVZCTREOQE-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 7-chloro-4-hydroxy-6-methoxyquinoline-3-carboxylate. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 7-chloro-4-hydroxy-6-methoxyquinoline-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 7-chloro-4-hydroxy-6-methoxyquinoline-3-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ethyl 7-chloro-4-hydroxy-6-methoxyquinoline-3-carboxylate is 1373767-56-6.
The molecular formula of Ethyl 7-chloro-4-hydroxy-6-methoxyquinoline-3-carboxylate is C13H12ClNO4.
The molecular weight of Ethyl 7-chloro-4-hydroxy-6-methoxyquinoline-3-carboxylate is 281.04547 g/mol.
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