Difenzoquat
TL;DR: Difenzoquat (CAS 49866-87-7) is a chemical compound with molecular formula C17H17N2+ and molecular weight 249.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dimethyl-3,5-diphenylpyrazol-2-ium
Also Known As: DIFENZOQUAT, difenzoquat iodide, Avenge CP, difenzoquat bromide, difenzoquat nitrate
| Molecular Formula | C17H17N2+ |
|---|---|
| Molecular Weight | 249.14 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 8.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.13918 |
| Heavy Atoms | 19 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 49866-87-7 |
|---|---|
| SMILES | CN1C(=CC(=[N+]1C)C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | LBGPXIPGGRQBJW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Difenzoquat (CAS 49866-87-7), with molecular formula C17H17N2+ and molecular weight 249.14 g/mol. IUPAC: 1,2-dimethyl-3,5-diphenylpyrazol-2-ium.
Chemical Property Profile of Difenzoquat
Property Insights of Difenzoquat
The XLogP value of 4.3 indicates that Difenzoquat is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 8.8 Ų, Difenzoquat exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Difenzoquat has 0 hydrogen bond donor(s) and 0 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 Difenzoquat?
The CAS number of Difenzoquat is 49866-87-7.
What is the molecular formula of Difenzoquat?
The molecular formula of Difenzoquat is C17H17N2+.
What is the molecular weight of Difenzoquat?
The molecular weight of Difenzoquat is 249.14 g/mol.
Where can I buy Difenzoquat?
You can request a quote for Difenzoquat directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Difenzoquat?
Yes, KEHONG BIO provides custom synthesis services for Difenzoquat and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.