Mefloquine carboxylic acid
TL;DR: Mefloquine carboxylic acid (CAS 40601-99-8) is a chemical compound with molecular formula C12H5F6NO2 and molecular weight 309.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,8-bis(trifluoromethyl)quinoline-4-carboxylic acid
Also Known As: Carboxymefloquine, 2,8-bis(trifluoromethyl)quinoline-4-carboxylic acid, Mefloquine carboxylic acid, 2,8-Mmq, CC-PMLSC-DMA-P115
| Molecular Formula | C12H5F6NO2 |
|---|---|
| Molecular Weight | 309.02 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 1 |
| Exact Mass | 309.02246 |
| Heavy Atoms | 21 |
| Complexity | 408.0 |
Chemical Identifiers
| CAS Number | 40601-99-8 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)C(F)(F)F)N=C(C=C2C(=O)O)C(F)(F)F |
| InChIKey | QJTJIQBSZLFWFS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Mefloquine carboxylic acid (CAS 40601-99-8), with molecular formula C12H5F6NO2 and molecular weight 309.02 g/mol. IUPAC: 2,8-bis(trifluoromethyl)quinoline-4-carboxylic acid.
Chemical Property Profile of Mefloquine carboxylic acid
Property Insights of Mefloquine carboxylic acid
The XLogP value of 3.5 indicates that Mefloquine 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, Mefloquine carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mefloquine carboxylic acid has 1 hydrogen bond donor(s) and 9 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 Mefloquine carboxylic acid?
The CAS number of Mefloquine carboxylic acid is 40601-99-8.
What is the molecular formula of Mefloquine carboxylic acid?
The molecular formula of Mefloquine carboxylic acid is C12H5F6NO2.
What is the molecular weight of Mefloquine carboxylic acid?
The molecular weight of Mefloquine carboxylic acid is 309.02 g/mol.
Where can I buy Mefloquine carboxylic acid?
You can request a quote for Mefloquine carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mefloquine carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for Mefloquine carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.