克利铵
TL;DR: 克利铵 (CAS 7020-55-5) is a chemical compound with molecular formula C22H26NO3+ and molecular weight 352.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
克利铵
(1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 2-hydroxy-2,2-diphenylacetate
Also Known As: clidinium, Clidinium ion, Clidinium cation, Quarzan, Clidinum
| Molecular Formula | C22H26NO3+ |
|---|---|
| Molecular Weight | 352.19 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 352.19125 |
| Heavy Atoms | 26 |
| Complexity | 482.0 |
| Melting Point | 240-241 °C |
Chemical Identifiers
| CAS Number | 7020-55-5 |
|---|---|
| SMILES | C[N+]12CCC(CC1)C(C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O |
| InChIKey | HOOSGZJRQIVJSZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
克利铵 (CAS 7020-55-5), with molecular formula C22H26NO3+ and molecular weight 352.19 g/mol. IUPAC: (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 2-hydroxy-2,2-diphenylacetate.
Chemical Property Profile of 克利铵
Property Insights of 克利铵
The XLogP value of 3.3 indicates that 克利铵 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 克利铵 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 克利铵 has 1 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 克利铵?
The CAS number of 克利铵 is 7020-55-5.
What is the molecular formula of 克利铵?
The molecular formula of 克利铵 is C22H26NO3+.
What is the molecular weight of 克利铵?
The molecular weight of 克利铵 is 352.19 g/mol.
Where can I buy 克利铵?
You can request a quote for 克利铵 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 克利铵?
Yes, KEHONG BIO provides custom synthesis services for 克利铵 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.