Clidinium Bromide
TL;DR: Clidinium Bromide (CAS 3485-62-9) is a chemical compound with molecular formula C22H26BrNO3 and molecular weight 431.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 2-hydroxy-2,2-diphenylacetate bromide
Also Known As: CLIDINIUM BROMIDE, Quarzan, Clidinii bromidum, Clidinium (bromide), Bromuro de clidinio
| Molecular Formula | C22H26BrNO3 |
|---|---|
| Molecular Weight | 431.11 g/mol |
| LogP | -0.29 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.10962 |
| Heavy Atoms | 27 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 3485-62-9 |
|---|---|
| SMILES | C[N+]12CCC(CC1)C(C2)OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.[Br-] |
| InChIKey | GKEGFOKQMZHVOW-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Clidinium Bromide (CAS 3485-62-9), with molecular formula C22H26BrNO3 and molecular weight 431.11 g/mol. IUPAC: (1-methyl-1-azoniabicyclo[2.2.2]octan-3-yl) 2-hydroxy-2,2-diphenylacetate bromide.
Chemical Property Profile of Clidinium Bromide
Property Insights of Clidinium Bromide
The XLogP value of -0.29 indicates that Clidinium Bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.5 Ų, Clidinium Bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Clidinium Bromide has 1 hydrogen bond donor(s) and 4 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 Clidinium Bromide?
The CAS number of Clidinium Bromide is 3485-62-9.
What is the molecular formula of Clidinium Bromide?
The molecular formula of Clidinium Bromide is C22H26BrNO3.
What is the molecular weight of Clidinium Bromide?
The molecular weight of Clidinium Bromide is 431.11 g/mol.
Where can I buy Clidinium Bromide?
You can request a quote for Clidinium Bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Clidinium Bromide?
Yes, KEHONG BIO provides custom synthesis services for Clidinium Bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.