羟氯喹
TL;DR: 羟氯喹 (CAS 118-42-3) is a chemical compound with molecular formula C18H26ClN3O and molecular weight 335.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
羟氯喹
2-[4-[(7-chloroquinolin-4-yl)amino]pentyl-ethylamino]ethanol
Also Known As: hydroxychloroquine, Plaquenil, Oxichloroquine, Oxychlorochin, Oxychloroquine
| Molecular Formula | C18H26ClN3O |
|---|---|
| Molecular Weight | 335.18 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 48.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 335.17645 |
| Heavy Atoms | 23 |
| Complexity | 331.0 |
| Melting Point | 89-91 |
| Solubility | 2.61e-02 g/L |
Chemical Identifiers
| CAS Number | 118-42-3 |
|---|---|
| SMILES | CCN(CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl)CCO |
| InChIKey | XXSMGPRMXLTPCZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
羟氯喹 (CAS 118-42-3), with molecular formula C18H26ClN3O and molecular weight 335.18 g/mol. IUPAC: 2-[4-[(7-chloroquinolin-4-yl)amino]pentyl-ethylamino]ethanol.
Chemical Property Profile of 羟氯喹
Property Insights of 羟氯喹
The XLogP value of 3.6 indicates that 羟氯喹 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.4 Ų, 羟氯喹 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 羟氯喹 has 2 hydrogen bond donor(s) and 4 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 羟氯喹?
The CAS number of 羟氯喹 is 118-42-3.
What is the molecular formula of 羟氯喹?
The molecular formula of 羟氯喹 is C18H26ClN3O.
What is the molecular weight of 羟氯喹?
The molecular weight of 羟氯喹 is 335.18 g/mol.
Where can I buy 羟氯喹?
You can request a quote for 羟氯喹 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 羟氯喹?
Yes, KEHONG BIO provides custom synthesis services for 羟氯喹 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.