Benzoxonium Chloride
TL;DR: Benzoxonium Chloride (CAS 19379-90-9) is a chemical compound with molecular formula C23H42ClNO2 and molecular weight 399.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Benzoxonium Chloride
benzyl-dodecyl-bis(2-hydroxyethyl)azanium chloride
Also Known As: Benzoxonium chloride, Bradophen, Absonal, Cohortan, Beloran
| Molecular Formula | C23H42ClNO2 |
|---|---|
| Molecular Weight | 399.29 g/mol |
| LogP | 1.91 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 17 |
| Exact Mass | 399.2904 |
| Heavy Atoms | 27 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 19379-90-9 |
|---|---|
| SMILES | CCCCCCCCCCCC[N+](CCO)(CCO)CC1=CC=CC=C1.[Cl-] |
| InChIKey | UUSQFLGKGQEVCM-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoxonium Chloride (CAS 19379-90-9), with molecular formula C23H42ClNO2 and molecular weight 399.29 g/mol. IUPAC: benzyl-dodecyl-bis(2-hydroxyethyl)azanium chloride.
Chemical Property Profile of Benzoxonium Chloride
Property Insights of Benzoxonium Chloride
The XLogP value of 1.91 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoxonium Chloride. With a topological polar surface area (TPSA) of 40.5 Ų, Benzoxonium Chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoxonium Chloride has 2 hydrogen bond donor(s) and 3 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 Benzoxonium Chloride?
The CAS number of Benzoxonium Chloride is 19379-90-9.
What is the molecular formula of Benzoxonium Chloride?
The molecular formula of Benzoxonium Chloride is C23H42ClNO2.
What is the molecular weight of Benzoxonium Chloride?
The molecular weight of Benzoxonium Chloride is 399.29 g/mol.
Where can I buy Benzoxonium Chloride?
You can request a quote for Benzoxonium Chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoxonium Chloride?
Yes, KEHONG BIO provides custom synthesis services for Benzoxonium Chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.