8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline
TL;DR: 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline (CAS 401567-86-0) is a chemical compound with molecular formula C14H13F4N3 and molecular weight 299.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline
Also Known As: 8-fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline, 1-[8-Fluoro-2-(trifluoromethyl)quinolin-4-yl]piperazine, 8-fluoro-4-(piperazin-1-yl)-2-(trifluoromethyl)quinoline, 1-[8-Fluoro-2-(trifluoromethyl)quinol-4-yl] piperazine, 1-[8-Fluoro-2-(trifluoromethyl)quinol-4-yl]piperazine
| Molecular Formula | C14H13F4N3 |
|---|---|
| Molecular Weight | 299.10 g/mol |
| LogP | 2.8023 |
| Topological Polar Surface Area | 28.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 299.10455 |
| Heavy Atoms | 21 |
| Complexity | 663.05206 |
Chemical Identifiers
| CAS Number | 401567-86-0 |
|---|---|
| SMILES | C1CN(CCN1)C2=CC(=NC3=C2C=CC=C3F)C(F)(F)F |
Product Overview
8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline (CAS 401567-86-0), with molecular formula C14H13F4N3 and molecular weight 299.10 g/mol. IUPAC: 8-fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline.
Chemical Property Profile of 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline
Property Insights of 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline
The XLogP value of 2.8023 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline. With a topological polar surface area (TPSA) of 28.16 Ų, 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline has 1 hydrogen bond donor(s) and 3 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 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline?
The CAS number of 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline is 401567-86-0.
What is the molecular formula of 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline?
The molecular formula of 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline is C14H13F4N3.
What is the molecular weight of 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline?
The molecular weight of 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline is 299.10 g/mol.
Where can I buy 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline?
You can request a quote for 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline?
Yes, KEHONG BIO provides custom synthesis services for 8-Fluoro-4-piperazin-1-yl-2-(trifluoromethyl)quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.