2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid
TL;DR: 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid (CAS 897553-40-1) is a chemical compound with molecular formula C18H13F2NO2 and molecular weight 313.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid
Also Known As: 2-(3,4-dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid, 2-(3,4-dimethylphenyl)-6,8-difluoro-quinoline-4-carboxylic Acid
| Molecular Formula | C18H13F2NO2 |
|---|---|
| Molecular Weight | 313.09 g/mol |
| LogP | 4.49504 |
| Topological Polar Surface Area | 50.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.09143 |
| Heavy Atoms | 23 |
| Complexity | 951.3947 |
Chemical Identifiers
| CAS Number | 897553-40-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3F)F)C(=C2)C(=O)O)C |
Product Overview
2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid (CAS 897553-40-1), with molecular formula C18H13F2NO2 and molecular weight 313.09 g/mol. IUPAC: 2-(3,4-dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid.
Chemical Property Profile of 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid
Property Insights of 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid
The XLogP value of 4.49504 indicates that 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.19 Ų, 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid?
The CAS number of 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid is 897553-40-1.
What is the molecular formula of 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid?
The molecular formula of 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid is C18H13F2NO2.
What is the molecular weight of 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid?
The molecular weight of 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid is 313.09 g/mol.
Where can I buy 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid?
You can request a quote for 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethylphenyl)-6,8-difluoroquinoline-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.