TL;DR: 6-Chloro-2-(4-chlorophenyl)quinoline-4-carboxylate (CAS 126088-20-8) is a chemical compound with molecular formula C16H8Cl2NO2- and molecular weight 315.9932 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-chloro-2-(4-chlorophenyl)quinoline-4-carboxylate
Also Known As: 6-chloro-2-(4-chlorophenyl)quinoline-4-carboxylate
| Molecular Formula | C16H8Cl2NO2- |
| Molecular Weight | 315.9932 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 53.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 315.9932 Da |
| Heavy Atoms | 21 |
| Complexity | 379.0 |
| SMILES | C1=CC(=CC=C1C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)[O-])Cl |
| InChIKey | ICGJQZNTTPOWLN-UHFFFAOYSA-M |
The XLogP value of 5.3 indicates that 6-Chloro-2-(4-chlorophenyl)quinoline-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.0 Ų, 6-Chloro-2-(4-chlorophenyl)quinoline-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Chloro-2-(4-chlorophenyl)quinoline-4-carboxylate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 6-Chloro-2-(4-chlorophenyl)quinoline-4-carboxylate is 126088-20-8.
The molecular formula of 6-Chloro-2-(4-chlorophenyl)quinoline-4-carboxylate is C16H8Cl2NO2-.
The molecular weight of 6-Chloro-2-(4-chlorophenyl)quinoline-4-carboxylate is 315.9932 g/mol.
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