Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)-
TL;DR: Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)- (CAS 114417-08-2) is a chemical compound with molecular formula C15H13Cl4N3O and molecular weight 390.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trichloro-1-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]ethanone
Also Known As: Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)-, 2,2,2-trichloro-1-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]ethanone, 3-chloro-2-methyl-4,5-dihydrothiophene 1,1-dioxide, 2,2,2-Trichloro-1-(4-(7-chloroquinolin-4-yl)piperazin-1-yl)ethanone, Ethanone,2,2,2-trichloro-1-[4-(7-chloro-4-quinolinyl)-1-piperazinyl]-
| Molecular Formula | C15H13Cl4N3O |
|---|---|
| Molecular Weight | 390.98 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 36.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 390.98126 |
| Heavy Atoms | 23 |
| Complexity | 437.0 |
Chemical Identifiers
| CAS Number | 114417-08-2 |
|---|---|
| SMILES | C1CN(CCN1C2=C3C=CC(=CC3=NC=C2)Cl)C(=O)C(Cl)(Cl)Cl |
| InChIKey | JGCSGGCUMJTQTI-UHFFFAOYSA-N |
Product Overview
Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)- (CAS 114417-08-2), with molecular formula C15H13Cl4N3O and molecular weight 390.98 g/mol. IUPAC: 2,2,2-trichloro-1-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]ethanone.
Chemical Property Profile of Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)-
Property Insights of Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)-
The XLogP value of 4.1 indicates that Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.4 Ų, Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)- has 0 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 Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)-?
The CAS number of Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)- is 114417-08-2.
What is the molecular formula of Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)-?
The molecular formula of Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)- is C15H13Cl4N3O.
What is the molecular weight of Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)-?
The molecular weight of Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)- is 390.98 g/mol.
Where can I buy Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)-?
You can request a quote for Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)-?
Yes, KEHONG BIO provides custom synthesis services for Piperazine, 1-(7-chloro-4-quinolinyl)-4-(trichloroacetyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.