5-Chloroisoquinoline
TL;DR: 5-Chloroisoquinoline (CAS 73075-43-1) is a chemical compound with molecular formula C9H6ClN and molecular weight 163.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloroisoquinoline
Also Known As: 5-chloroisoquinoline, 5-Chloro-isoquinoline, isoquinoline, 5-chloro-, 5 - Chloroisoquinoline, 5-Chloroisoquinoline, 97%
| Molecular Formula | C9H6ClN |
|---|---|
| Molecular Weight | 163.02 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 163.01888 |
| Heavy Atoms | 11 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 73075-43-1 |
|---|---|
| SMILES | C1=CC2=C(C=CN=C2)C(=C1)Cl |
| InChIKey | PJHSMEMFNSINJE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Chloroisoquinoline (CAS 73075-43-1), with molecular formula C9H6ClN and molecular weight 163.02 g/mol. IUPAC: 5-chloroisoquinoline.
Chemical Property Profile of 5-Chloroisoquinoline
Property Insights of 5-Chloroisoquinoline
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloroisoquinoline. With a topological polar surface area (TPSA) of 12.9 Ų, 5-Chloroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloroisoquinoline has 0 hydrogen bond donor(s) and 1 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 5-Chloroisoquinoline?
The CAS number of 5-Chloroisoquinoline is 73075-43-1.
What is the molecular formula of 5-Chloroisoquinoline?
The molecular formula of 5-Chloroisoquinoline is C9H6ClN.
What is the molecular weight of 5-Chloroisoquinoline?
The molecular weight of 5-Chloroisoquinoline is 163.02 g/mol.
Where can I buy 5-Chloroisoquinoline?
You can request a quote for 5-Chloroisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.