TL;DR: 7-Chloro-2-(2,5-dichlorophenyl)-8-methylquinoline-4-carboxylic acid (CAS 133059-44-6) is a chemical compound with molecular formula C17H10Cl3NO2 and molecular weight 364.97772 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-chloro-2-(2,5-dichlorophenyl)-8-methylquinoline-4-carboxylic acid
Also Known As: 7-chloro-2-(2,5-dichlorophenyl)-8-methylquinoline-4-carboxylic acid, 4-Bromo-3-fluorobenzonitrile, 7-chloro-2-(2,5-dichlorophenyl)-8-methyl-quinoline-4-carboxylic Acid, 7-chloro-2-(2,5-dichlorophenyl)-8-methylquinoline-4-carboxylicacid, H21084
| Molecular Formula | C17H10Cl3NO2 |
| Molecular Weight | 364.97772 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 364.97772 Da |
| Heavy Atoms | 23 |
| Complexity | 450.0 |
| SMILES | CC1=C(C=CC2=C1N=C(C=C2C(=O)O)C3=C(C=CC(=C3)Cl)Cl)Cl |
| InChIKey | IMAWAZYPLZKRDE-UHFFFAOYSA-N |
The XLogP value of 5.6 indicates that 7-Chloro-2-(2,5-dichlorophenyl)-8-methylquinoline-4-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.2 Ų, 7-Chloro-2-(2,5-dichlorophenyl)-8-methylquinoline-4-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Chloro-2-(2,5-dichlorophenyl)-8-methylquinoline-4-carboxylic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 7-Chloro-2-(2,5-dichlorophenyl)-8-methylquinoline-4-carboxylic acid is 133059-44-6.
The molecular formula of 7-Chloro-2-(2,5-dichlorophenyl)-8-methylquinoline-4-carboxylic acid is C17H10Cl3NO2.
The molecular weight of 7-Chloro-2-(2,5-dichlorophenyl)-8-methylquinoline-4-carboxylic acid is 364.97772 g/mol.
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