Difenzoquat metilsulfate
TL;DR: Difenzoquat metilsulfate (CAS 43222-48-6) is a chemical compound with molecular formula C18H20N2O4S and molecular weight 360.11438 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2-dimethyl-3,5-diphenylpyrazol-2-ium;methyl sulfate
Also Known As: Difenzoquat metilsulfate, Difenzoquat methyl sulfate, Finaven, AVENGE, Yeh-Yan-Ku
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H20N2O4S |
| Molecular Weight | 360.11438 g/mol |
| XLogP | 2.28 |
| Topological Polar Surface Area (TPSA) | 83.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 360.11438 Da |
| Heavy Atoms | 25 |
| Complexity | 342.0 |
| SMILES | CN1C(=CC(=[N+]1C)C2=CC=CC=C2)C3=CC=CC=C3.COS(=O)(=O)[O-] |
| InChIKey | XQEMNBNCQVQXMO-UHFFFAOYSA-M |
Chemical Property Profile of Difenzoquat metilsulfate
Property Insights of Difenzoquat metilsulfate
The XLogP value of 2.28 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Difenzoquat metilsulfate. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Difenzoquat metilsulfate. Following Lipinski's Rule of Five, Difenzoquat metilsulfate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Difenzoquat metilsulfate?
The CAS number of Difenzoquat metilsulfate is 43222-48-6.
What is the molecular formula of Difenzoquat metilsulfate?
The molecular formula of Difenzoquat metilsulfate is C18H20N2O4S.
What is the molecular weight of Difenzoquat metilsulfate?
The molecular weight of Difenzoquat metilsulfate is 360.11438 g/mol.
Where can I buy Difenzoquat metilsulfate?
You can request a quote for Difenzoquat metilsulfate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Difenzoquat metilsulfate?
Yes, CoreyChem provides custom synthesis services for Difenzoquat metilsulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.