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Sulfadoxine structure
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Sulfadoxine

TL;DR: Sulfadoxine (CAS 2447-57-6) is a chemical compound with molecular formula C12H14N4O4S and molecular weight 310.07358 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-amino-N-(5,6-dimethoxypyrimidin-4-yl)benzenesulfonamide

Also Known As: SULFADOXINE, Sulphadoxine, Sulfadoxin, Sulforthomidine, Sulphormethoxine

CAS Number
2447-57-6
Molecular Formula
C12H14N4O4S
Molecular Weight
310.07358 g/mol
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Application Areas

Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (31 patents) Analytical Reagents (109 patents) Biotechnology (195 patents) Catalysts (10 patents) Coatings & Adhesives (2 patents)

Technical Specifications

Molecular FormulaC12H14N4O4S
Molecular Weight310.07358 g/mol
XLogP0.7
Topological Polar Surface Area (TPSA)125.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors8
Rotatable Bonds5
Exact Mass310.07358 Da
Heavy Atoms21
Complexity419.0
Melting Point190-194 °C
Solubility2.96e-01 g/L
SMILESCOC1=C(N=CN=C1OC)NS(=O)(=O)C2=CC=C(C=C2)N
InChIKeyPJSFRIWCGOHTNF-UHFFFAOYSA-N

Chemical Property Profile of Sulfadoxine

XLogP
0.7
TPSA (Topological Polar Surface Area)
125.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
8
Rotatable Bonds
5
Heavy Atoms
21
Complexity
419.0
Exact Mass
310.07358
Monoisotopic Mass
310.07358
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Sulfadoxine

The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sulfadoxine. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sulfadoxine. Following Lipinski's Rule of Five, Sulfadoxine has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Sulfadoxine?

The CAS number of Sulfadoxine is 2447-57-6.

What is the molecular formula of Sulfadoxine?

The molecular formula of Sulfadoxine is C12H14N4O4S.

What is the molecular weight of Sulfadoxine?

The molecular weight of Sulfadoxine is 310.07358 g/mol.

Where can I buy Sulfadoxine?

You can request a quote for Sulfadoxine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Sulfadoxine?

Yes, CoreyChem provides custom synthesis services for Sulfadoxine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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