7-Chloro-4-(piperazin-1-yl)quinoline
TL;DR: 7-Chloro-4-(piperazin-1-yl)quinoline (CAS 837-52-5) is a chemical compound with molecular formula C13H14ClN3 and molecular weight 247.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-4-piperazin-1-ylquinoline
Also Known As: 7-chloro-4-(piperazin-1-yl)quinoline, 7-Chloro-4-piperazinoquinoline, 7-Chloro-4-piperazinylquinoline, 7-Chloro-4-piperazin-1-yl-quinoline, Chloroquinolinylpiperazine
| Molecular Formula | C13H14ClN3 |
|---|---|
| Molecular Weight | 247.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 247.08763 |
| Heavy Atoms | 17 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 837-52-5 |
|---|---|
| SMILES | C1CN(CCN1)C2=C3C=CC(=CC3=NC=C2)Cl |
| InChIKey | DNXNPMDUDGUXOB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-Chloro-4-(piperazin-1-yl)quinoline (CAS 837-52-5), with molecular formula C13H14ClN3 and molecular weight 247.09 g/mol. IUPAC: 7-chloro-4-piperazin-1-ylquinoline.
Chemical Property Profile of 7-Chloro-4-(piperazin-1-yl)quinoline
Property Insights of 7-Chloro-4-(piperazin-1-yl)quinoline
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Chloro-4-(piperazin-1-yl)quinoline. With a topological polar surface area (TPSA) of 28.2 Ų, 7-Chloro-4-(piperazin-1-yl)quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Chloro-4-(piperazin-1-yl)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 7-Chloro-4-(piperazin-1-yl)quinoline?
The CAS number of 7-Chloro-4-(piperazin-1-yl)quinoline is 837-52-5.
What is the molecular formula of 7-Chloro-4-(piperazin-1-yl)quinoline?
The molecular formula of 7-Chloro-4-(piperazin-1-yl)quinoline is C13H14ClN3.
What is the molecular weight of 7-Chloro-4-(piperazin-1-yl)quinoline?
The molecular weight of 7-Chloro-4-(piperazin-1-yl)quinoline is 247.09 g/mol.
Where can I buy 7-Chloro-4-(piperazin-1-yl)quinoline?
You can request a quote for 7-Chloro-4-(piperazin-1-yl)quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Chloro-4-(piperazin-1-yl)quinoline?
Yes, KEHONG BIO provides custom synthesis services for 7-Chloro-4-(piperazin-1-yl)quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.