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Hydroxychloroquine (sulfate) (Standard)

CAT: 0804-HY-B1370R-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-B1370R-01Size:5 mg
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Description
Hydroxychloroquine (sulfate) (Standard) is the analytical standard of Hydroxychloroquine (sulfate) . This product is intended for research and analytical applications. Hydroxychloroquine sulfate (HCQ sulfate) is a synthetic antimalarial agent which can also inhibit Toll-like receptor 7/9 (TLR7/9) signaling. Hydroxychloroquine sulfate is efficiently inhibits SARS-CoV-2 infection in vitro[1][2][3].
CAS Number
747-36-4
Product Name Alternative
HCQ (sulfate) (Standard)
UNSPSC
12352005
Hazard Statement
H302, H315, H319
Target
Autophagy; Parasite; Reference Standards; SARS-CoV; Toll-like Receptor (TLR)
Type
Reference Standards
Related Pathways
Anti-infection; Autophagy; Immunology/Inflammation; Others
Applications
COVID-19-anti-virus
Field of Research
Cancer; Infection
Assay Protocol
https://www.medchemexpress.com/hydroxychloroquine-sulfate-standard.html
Purity
99.96
Solubility
H2O : 110 mg/mL (ultrasonic; warming)
Smiles
CCN(CCO)CCCC(NC1=CC=NC2=CC(Cl)=CC=C12)C.O=S(O)(O)=O
Molecular Formula
C18H28ClN3O5S
Molecular Weight
433.95
Precautions
H302, H315, H319
Shipping Conditions
Room Temperature
Storage Conditions
4°C, sealed and dry storage, away from light and moisture
Scientific Category
Reference Standards
Clinical Information
No Development Reported
Isoform
Plasmodium; TLR7; TLR9

Chemical Information

Hydroxychloroquine Sulfate

Hydroxychloroquine Sulfate is a synthetic derivative of quinolyl with chemotherapeutic and antibiotic properties, Hydroxychloroquine Sulfate acts against erythrocytic malarial parasites (Plasmodium vivax, ovale, and malariae) by concentrating in food vacuoles. It inhibits plasmodial heme polymerase and acts through other unknown mechanisms. Hydroxychloroquine also has anti-inflammatory properties and is used in the treatment of rheumatoid arthritis and lupus erythematosus. (NCI04)

CAS Number747-36-4
PubChem CID12947
IUPAC Name2-[4-[(7-chloroquinolin-4-yl)amino]pentyl-ethylamino]ethanol;sulfuric acid
Molecular FormulaC18H28ClN3O5S
Molecular Weight434.0
Topological Polar Surface Area131
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Heavy Atom Count28
Formal Charge0
Complexity413
SMILES
CCN(CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl)CCO.OS(=O)(=O)O
InChI
InChI=1S/C18H26ClN3O.H2O4S/c1-3-22(11-12-23)10-4-5-14(2)21-17-8-9-20-18-13-15(19)6-7-16(17)18;1-5(2,3)4/h6-9,13-14,23H,3-5,10-12H2,1-2H3,(H,20,21);(H2,1,2,3,4)
InChIKey
JCBIVZZPXRZKTI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Hydroxychloroquine Sulfate
CAS: 747-36-4
CID: 12947
Formula: C18H28ClN3O5S
MW: 434.0
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight434.0
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Exact Mass433.1438199
Monoisotopic Mass433.1438199
Topological Polar Surface Area131 Ų
Heavy Atom Count28
Formal Charge0
Complexity413
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes