TL;DR: Quinmerac (CAS 90717-03-6) is a chemical compound with molecular formula C11H8ClNO2 and molecular weight 221.02435 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-chloro-3-methylquinoline-8-carboxylic acid
Also Known As: Quinmerac, Fiesta, 7-Chloro-3-methylquinoline-8-carboxylic acid, Gavelan, Bonus
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H8ClNO2 |
| Molecular Weight | 221.02435 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.02435 Da |
| Heavy Atoms | 15 |
| Complexity | 259.0 |
| SMILES | CC1=CC2=C(C(=C(C=C2)Cl)C(=O)O)N=C1 |
| InChIKey | ALZOLUNSQWINIR-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinmerac. With a topological polar surface area (TPSA) of 50.2 Ų, Quinmerac exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinmerac has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Quinmerac is 90717-03-6.
The molecular formula of Quinmerac is C11H8ClNO2.
The molecular weight of Quinmerac is 221.02435 g/mol.
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