Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride
TL;DR: Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride (CAS 51941-04-9) is a chemical compound with molecular formula C30H28Cl2F6N4O3 and molecular weight 676.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl 2-[[7-(trifluoromethoxy)quinolin-4-yl]amino]benzoate;dihydrochloride
Also Known As: Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride, 2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl 2-[[7-(trifluoromethoxy)quinolin-4-yl]amino]benzoate dihydrochloride, 2-{4-[3-(Trifluoromethyl)phenyl]piperazin-1-yl}ethyl 2-{[7-(trifluoromethoxy)quinolin-4-yl]amino}benzoate--hydrogen chloride (1/2), Benzoic acid, 2-[[7-(trifluoromethoxy)-4-quinolinyl]amino]-, 2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl ester, dihydrochloride, RefChem:372702
| Molecular Formula | C30H28Cl2F6N4O3 |
|---|---|
| Molecular Weight | 676.14 g/mol |
| LogP | 7.7184 |
| Topological Polar Surface Area | 66.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 676.1443 |
| Heavy Atoms | 45 |
| Complexity | 1598.2625 |
Chemical Identifiers
| CAS Number | 51941-04-9 |
|---|---|
| SMILES | C1CN(CCN1CCOC(=O)C2=CC=CC=C2NC3=C4C=CC(=CC4=NC=C3)OC(F)(F)F)C5=CC=CC(=C5)C(F)(F)F.Cl.Cl |
Product Overview
Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride (CAS 51941-04-9), with molecular formula C30H28Cl2F6N4O3 and molecular weight 676.14 g/mol. IUPAC: 2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl 2-[[7-(trifluoromethoxy)quinolin-4-yl]amino]benzoate;dihydrochloride.
Chemical Property Profile of Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride
Property Insights of Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride
The XLogP value of 7.7184 indicates that Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.93 Ų falls within the moderate polarity range, balancing permeability and solubility for Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride. Following Lipinski's Rule of Five, Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride?
The CAS number of Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride is 51941-04-9.
What is the molecular formula of Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride?
The molecular formula of Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride is C30H28Cl2F6N4O3.
What is the molecular weight of Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride?
The molecular weight of Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride is 676.14 g/mol.
Where can I buy Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride?
You can request a quote for Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-trifluoromethoxy-4-quinolyl)anthranilate, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.