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Oltipraz structure
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Oltipraz

TL;DR: Oltipraz (CAS 64224-21-1) is a chemical compound with molecular formula C8H6N2S3 and molecular weight 225.96931 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-methyl-5-pyrazin-2-yldithiole-3-thione

Also Known As: Oltipraz, Oltiprazum, Oltipraz [INN], Oltipraz?, 4-methyl-PDT

CAS Number
64224-21-1
Molecular Formula
C8H6N2S3
Molecular Weight
225.96931 g/mol
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Application Areas

Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (15 patents) Analytical Reagents (42 patents) Biotechnology (179 patents) Food Additives (60 patents) Heterocyclic Building Blocks (344 patents)

Technical Specifications

Molecular FormulaC8H6N2S3
Molecular Weight225.96931 g/mol
XLogP1.1
Topological Polar Surface Area (TPSA)108.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors5
Rotatable Bonds1
Exact Mass225.96931 Da
Heavy Atoms13
Complexity262.0
SMILESCC1=C(SSC1=S)C2=NC=CN=C2
InChIKeyCKNAQFVBEHDJQV-UHFFFAOYSA-N

Chemical Property Profile of Oltipraz

XLogP
1.1
TPSA (Topological Polar Surface Area)
108.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
1
Heavy Atoms
13
Complexity
262.0
Exact Mass
225.96931
Monoisotopic Mass
225.96931
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 Oltipraz

The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oltipraz. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Oltipraz. Following Lipinski's Rule of Five, Oltipraz has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Oltipraz?

The CAS number of Oltipraz is 64224-21-1.

What is the molecular formula of Oltipraz?

The molecular formula of Oltipraz is C8H6N2S3.

What is the molecular weight of Oltipraz?

The molecular weight of Oltipraz is 225.96931 g/mol.

Where can I buy Oltipraz?

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

Does CoreyChem offer custom synthesis for Oltipraz?

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

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