Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride
TL;DR: Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride (CAS 55366-85-3) is a chemical compound with molecular formula C29H28Cl3F3N4O2 and molecular weight 626.12 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-chloroquinolin-4-yl)amino]benzoate;dihydrochloride
Also Known As: Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride, 4-(3-Trifluoromethyl)phenylpiperazineethanol o-(7-chloro-4-quinolylamino)benzoate 2HCl, 2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl 2-[(7-chloroquinolin-4-yl)amino]benzoate dihydrochloride, 2-{4-[3-(Trifluoromethyl)phenyl]piperazin-1-yl}ethyl 2-[(7-chloroquinolin-4-yl)amino]benzoate--hydrogen chloride (1/2), Benzoic acid, 2-[(7-chloro-4-quinolinyl)amino]-, 2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl ester, dihydrochloride
| Molecular Formula | C29H28Cl3F3N4O2 |
|---|---|
| Molecular Weight | 626.12 g/mol |
| LogP | 7.4732 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 626.123 |
| Heavy Atoms | 41 |
| Complexity | 1481.4132 |
Chemical Identifiers
| CAS Number | 55366-85-3 |
|---|---|
| SMILES | C1CN(CCN1CCOC(=O)C2=CC=CC=C2NC3=C4C=CC(=CC4=NC=C3)Cl)C5=CC=CC(=C5)C(F)(F)F.Cl.Cl |
Product Overview
Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride (CAS 55366-85-3), with molecular formula C29H28Cl3F3N4O2 and molecular weight 626.12 g/mol. IUPAC: 2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl 2-[(7-chloroquinolin-4-yl)amino]benzoate;dihydrochloride.
Chemical Property Profile of Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride
Property Insights of Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride
The XLogP value of 7.4732 indicates that Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.7 Ų, Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride has 1 hydrogen bond donor(s) and 6 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-chloro-4-quinolyl)anthranilate, dihydrochloride?
The CAS number of Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride is 55366-85-3.
What is the molecular formula of Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride?
The molecular formula of Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride is C29H28Cl3F3N4O2.
What is the molecular weight of Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride?
The molecular weight of Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride is 626.12 g/mol.
Where can I buy Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride?
You can request a quote for Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-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-chloro-4-quinolyl)anthranilate, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Piperazineethanol, 4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.