2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid
TL;DR: 2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid (CAS 147621-18-9) is a chemical compound with molecular formula C21H20ClNO2 and molecular weight 353.11826 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid
Also Known As: 2-(4-tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid, Indole-6-boronic acid, 2-(4-(tert-Butyl)phenyl)-7-chloro-8-methylquinoline-4-carboxylic acid, 2-(4-(tert-Butyl)phenyl)-7-chloro-8-methylquinoline-4-carboxylicacid, 2-(4-tert-butylphenyl)-7-chloro-8-methyl-quinoline-4-carboxylic acid
Technical Specifications
| Molecular Formula | C21H20ClNO2 |
| Molecular Weight | 353.11826 g/mol |
| XLogP | 6.0 |
| Topological Polar Surface Area (TPSA) | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 353.11826 Da |
| Heavy Atoms | 25 |
| Complexity | 481.0 |
| SMILES | CC1=C(C=CC2=C1N=C(C=C2C(=O)O)C3=CC=C(C=C3)C(C)(C)C)Cl |
| InChIKey | HUBDTESIVRBGJC-UHFFFAOYSA-N |
Chemical Property Profile of 2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid
Property Insights of 2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid
The XLogP value of 6.0 indicates that 2-(4-Tert-butylphenyl)-7-chloro-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, 2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid?
The CAS number of 2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid is 147621-18-9.
What is the molecular formula of 2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid?
The molecular formula of 2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid is C21H20ClNO2.
What is the molecular weight of 2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid?
The molecular weight of 2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid is 353.11826 g/mol.
Where can I buy 2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid?
You can request a quote for 2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 2-(4-Tert-butylphenyl)-7-chloro-8-methylquinoline-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.