![1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride structure](/static/products/497/49730-33-8.png)
1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride
TL;DR: 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride (CAS 49730-33-8) is a chemical compound with molecular formula C12H19ClN4O2 and molecular weight 286.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride
Also Known As: 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)quinuclidinium chloride, 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane Chloride
| Molecular Formula | C12H19ClN4O2 |
|---|---|
| Molecular Weight | 286.12 g/mol |
| LogP | -1.9862 |
| Topological Polar Surface Area | 57.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.11966 |
| Heavy Atoms | 19 |
| Complexity | 413.33112 |
Chemical Identifiers
| CAS Number | 49730-33-8 |
|---|---|
| SMILES | COC1=NC(=NC(=N1)[N+]23CCC(CC2)CC3)OC.[Cl-] |
Product Overview
1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride (CAS 49730-33-8), with molecular formula C12H19ClN4O2 and molecular weight 286.12 g/mol. IUPAC: 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride.
Chemical Property Profile of 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride
Property Insights of 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride
The XLogP value of -1.9862 indicates that 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.13 Ų, 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride 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
Frequently Asked Questions
What is the CAS number of 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride?
The CAS number of 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride is 49730-33-8.
What is the molecular formula of 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride?
The molecular formula of 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride is C12H19ClN4O2.
What is the molecular weight of 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride?
The molecular weight of 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride is 286.12 g/mol.
Where can I buy 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride?
You can request a quote for 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride?
Yes, KEHONG BIO provides custom synthesis services for 1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.