2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline
TL;DR: 2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline (CAS 684646-73-9) is a chemical compound with molecular formula C20H20N4O2 and molecular weight 348.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]quinoline
Also Known As: 2-[4-(4-nitrobenzyl)piperazin-1-yl]quinoline, 2-[4-[(4-Nitrophenyl)methyl]-1-piperazinyl]quinoline, 2-{4-[(4-nitrophenyl)methyl]piperazin-1-yl}quinoline, 2-[4-(4-Nitrobenzyl)-1-piperazinyl]quinoline #, Piperazine, 1-(4-nitrobenzyl)-4-(2-quinolyl)-
| Molecular Formula | C20H20N4O2 |
|---|---|
| Molecular Weight | 348.16 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 65.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.15863 |
| Heavy Atoms | 26 |
| Complexity | 467.0 |
Chemical Identifiers
| CAS Number | 684646-73-9 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=C(C=C2)[N+](=O)[O-])C3=NC4=CC=CC=C4C=C3 |
| InChIKey | QJBZOZMCUNYRQI-UHFFFAOYSA-N |
Product Overview
2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline (CAS 684646-73-9), with molecular formula C20H20N4O2 and molecular weight 348.16 g/mol. IUPAC: 2-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]quinoline.
Chemical Property Profile of 2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline
Property Insights of 2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline
The XLogP value of 3.8 indicates that 2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline. Following Lipinski's Rule of Five, 2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline has 0 hydrogen bond donor(s) and 5 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-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline?
The CAS number of 2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline is 684646-73-9.
What is the molecular formula of 2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline?
The molecular formula of 2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline is C20H20N4O2.
What is the molecular weight of 2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline?
The molecular weight of 2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline is 348.16 g/mol.
Where can I buy 2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline?
You can request a quote for 2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-((4-Nitrophenyl)methyl)-1-piperazinyl)quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.