TL;DR: 6-Bromo-2-methylquinoline-4-carboxylic acid (CAS 37509-21-0) is a chemical compound with molecular formula C11H8BrNO2 and molecular weight 264.97385 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-bromo-2-methylquinoline-4-carboxylic acid
Also Known As: 6-bromo-2-methylquinoline-4-carboxylic acid, 6-Bromo-2-methyl-quinoline-4-carboxylic acid, ZERENEX E/6110101, BUTTPARK 180\07-64, ZERO/005493
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H8BrNO2 |
| Molecular Weight | 264.97385 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 264.97385 Da |
| Heavy Atoms | 15 |
| Complexity | 259.0 |
| SMILES | CC1=CC(=C2C=C(C=CC2=N1)Br)C(=O)O |
| InChIKey | QOTNALKWUMJLPS-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Bromo-2-methylquinoline-4-carboxylic acid. With a topological polar surface area (TPSA) of 50.2 Ų, 6-Bromo-2-methylquinoline-4-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Bromo-2-methylquinoline-4-carboxylic acid 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 6-Bromo-2-methylquinoline-4-carboxylic acid is 37509-21-0.
The molecular formula of 6-Bromo-2-methylquinoline-4-carboxylic acid is C11H8BrNO2.
The molecular weight of 6-Bromo-2-methylquinoline-4-carboxylic acid is 264.97385 g/mol.
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