TL;DR: 3,8-Dimethyl-2-(4-methylphenyl)quinoline-4-carboxylic acid (CAS 886686-15-3) is a chemical compound with molecular formula C19H17NO2 and molecular weight 291.12592 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxylic acid
Also Known As: 3,8-dimethyl-2-(4-methylphenyl)quinoline-4-carboxylic acid, 3,8-Dimethyl-2-(p-tolyl)quinoline-4-carboxylic acid, 3,8-Dimethyl-2-(p-tolyl)quinoline-4-carboxylicacid, H21012
| Molecular Formula | C19H17NO2 |
| Molecular Weight | 291.12592 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 291.12592 Da |
| Heavy Atoms | 22 |
| Complexity | 402.0 |
| SMILES | CC1=CC=C(C=C1)C2=NC3=C(C=CC=C3C(=C2C)C(=O)O)C |
| InChIKey | UVCGUUPBIALSIL-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that 3,8-Dimethyl-2-(4-methylphenyl)quinoline-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, 3,8-Dimethyl-2-(4-methylphenyl)quinoline-4-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,8-Dimethyl-2-(4-methylphenyl)quinoline-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 3,8-Dimethyl-2-(4-methylphenyl)quinoline-4-carboxylic acid is 886686-15-3.
The molecular formula of 3,8-Dimethyl-2-(4-methylphenyl)quinoline-4-carboxylic acid is C19H17NO2.
The molecular weight of 3,8-Dimethyl-2-(4-methylphenyl)quinoline-4-carboxylic acid is 291.12592 g/mol.
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