Cyclopyrronium Bromide
TL;DR: Cyclopyrronium Bromide (CAS 15599-22-1) is a chemical compound with molecular formula C20H30BrNO2 and molecular weight 395.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-ethyl-1-methylpyrrolidin-1-ium-3-yl) 2-cyclopentyl-2-phenylacetate bromide
Also Known As: Cyclopyrronium Bromide, Cyclopyrronii bromidum, Bromuro de ciclopirronio, Bromure de cyclopyrronium, cyclopyrroniumbromid
| Molecular Formula | C20H30BrNO2 |
|---|---|
| Molecular Weight | 395.15 g/mol |
| LogP | 0.75 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 395.146 |
| Heavy Atoms | 24 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 15599-22-1 |
|---|---|
| SMILES | CC[N+]1(CCC(C1)OC(=O)C(C2CCCC2)C3=CC=CC=C3)C.[Br-] |
| InChIKey | HZVNJIOPUIMLRO-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclopyrronium Bromide (CAS 15599-22-1), with molecular formula C20H30BrNO2 and molecular weight 395.15 g/mol. IUPAC: (1-ethyl-1-methylpyrrolidin-1-ium-3-yl) 2-cyclopentyl-2-phenylacetate bromide.
Chemical Property Profile of Cyclopyrronium Bromide
Property Insights of Cyclopyrronium Bromide
The XLogP value of 0.75 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopyrronium Bromide. With a topological polar surface area (TPSA) of 26.3 Ų, Cyclopyrronium Bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopyrronium Bromide has 0 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 Cyclopyrronium Bromide?
The CAS number of Cyclopyrronium Bromide is 15599-22-1.
What is the molecular formula of Cyclopyrronium Bromide?
The molecular formula of Cyclopyrronium Bromide is C20H30BrNO2.
What is the molecular weight of Cyclopyrronium Bromide?
The molecular weight of Cyclopyrronium Bromide is 395.15 g/mol.
Where can I buy Cyclopyrronium Bromide?
You can request a quote for Cyclopyrronium Bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopyrronium Bromide?
Yes, KEHONG BIO provides custom synthesis services for Cyclopyrronium Bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.