methyl}quinoline structure](/static/products/5008/5008-26-4.webp)
2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline
TL;DR: 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline (CAS 5008-26-4) is a chemical compound with molecular formula C21H19ClF3N3 and molecular weight 405.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-chloro-5-(trifluoromethyl)phenyl]-piperazin-1-ylmethyl]quinoline
Also Known As: 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline, 2-[[2-chloro-5-(trifluoromethyl)phenyl]-piperazin-1-yl-methyl]quinoline, 2-[[2-chloro-5-(trifluoromethyl)phenyl]-piperazin-1-ylmethyl]quinoline
| Molecular Formula | C21H19ClF3N3 |
|---|---|
| Molecular Weight | 405.12 g/mol |
| LogP | 4.9016 |
| Topological Polar Surface Area | 28.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 405.12195 |
| Heavy Atoms | 28 |
| Complexity | 984.0369 |
Chemical Identifiers
| CAS Number | 5008-26-4 |
|---|---|
| SMILES | C1CN(CCN1)C(C2=NC3=CC=CC=C3C=C2)C4=C(C=CC(=C4)C(F)(F)F)Cl |
Product Overview
2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline (CAS 5008-26-4), with molecular formula C21H19ClF3N3 and molecular weight 405.12 g/mol. IUPAC: 2-[[2-chloro-5-(trifluoromethyl)phenyl]-piperazin-1-ylmethyl]quinoline.
Chemical Property Profile of 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline
Property Insights of 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline
The XLogP value of 4.9016 indicates that 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.16 Ų, 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}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 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline?
The CAS number of 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline is 5008-26-4.
What is the molecular formula of 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline?
The molecular formula of 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline is C21H19ClF3N3.
What is the molecular weight of 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline?
The molecular weight of 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline is 405.12 g/mol.
Where can I buy 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline?
You can request a quote for 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline?
Yes, KEHONG BIO provides custom synthesis services for 2-{[2-Chloro-5-(trifluoromethyl)phenyl](piperazin-1-yl)methyl}quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.