TL;DR: 5,7-Dichloro-4-hydroxy-quinoline-2-carboxylic acid ethyl ester (CAS 157848-08-3) is a chemical compound with molecular formula C12H9Cl2NO3 and molecular weight 284.99594 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 5,7-dichloro-4-oxo-1H-quinoline-2-carboxylate
Also Known As: 5,7-Dichloro-4-hydroxy-quinoline-2-carboxylic acid ethyl ester, ethyl 5,7-dichloro-4-hydroxyquinoline-2-carboxylate, ethyl 5,7-dichloro-4-oxo-1H-quinoline-2-carboxylate, AE-641/05537061, A-2011
| Molecular Formula | C12H9Cl2NO3 |
| Molecular Weight | 284.99594 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.99594 Da |
| Heavy Atoms | 18 |
| Complexity | 397.0 |
| SMILES | CCOC(=O)C1=CC(=O)C2=C(N1)C=C(C=C2Cl)Cl |
| InChIKey | PAWVWSJNXBGMBO-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 5,7-Dichloro-4-hydroxy-quinoline-2-carboxylic acid ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, 5,7-Dichloro-4-hydroxy-quinoline-2-carboxylic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,7-Dichloro-4-hydroxy-quinoline-2-carboxylic acid ethyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5,7-Dichloro-4-hydroxy-quinoline-2-carboxylic acid ethyl ester is 157848-08-3.
The molecular formula of 5,7-Dichloro-4-hydroxy-quinoline-2-carboxylic acid ethyl ester is C12H9Cl2NO3.
The molecular weight of 5,7-Dichloro-4-hydroxy-quinoline-2-carboxylic acid ethyl ester is 284.99594 g/mol.
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