Halopenium Chloride
TL;DR: Halopenium Chloride (CAS 90408-79-0) is a chemical compound with molecular formula C22H30BrCl2NO and molecular weight 473.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Halopenium Chloride
(4-bromophenyl)methyl-[3-(4-chloro-5-methyl-2-propan-2-ylphenoxy)propyl]-dimethylazanium chloride
Also Known As: Halopenium chloride, halopone chloride, Halopenii chloridum, Chlorure d'halopenium, cloruro de halopenio
| Molecular Formula | C22H30BrCl2NO |
|---|---|
| Molecular Weight | 473.09 g/mol |
| LogP | 3.58382 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 473.08878 |
| Heavy Atoms | 27 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 90408-79-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)C(C)C)OCCC[N+](C)(C)CC2=CC=C(C=C2)Br.[Cl-] |
| InChIKey | ISVREOQRBYZKHL-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Halopenium Chloride (CAS 90408-79-0), with molecular formula C22H30BrCl2NO and molecular weight 473.09 g/mol. IUPAC: (4-bromophenyl)methyl-[3-(4-chloro-5-methyl-2-propan-2-ylphenoxy)propyl]-dimethylazanium chloride.
Chemical Property Profile of Halopenium Chloride
Property Insights of Halopenium Chloride
The XLogP value of 3.58382 indicates that Halopenium Chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Halopenium Chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Halopenium Chloride has 0 hydrogen bond donor(s) and 2 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 Halopenium Chloride?
The CAS number of Halopenium Chloride is 90408-79-0.
What is the molecular formula of Halopenium Chloride?
The molecular formula of Halopenium Chloride is C22H30BrCl2NO.
What is the molecular weight of Halopenium Chloride?
The molecular weight of Halopenium Chloride is 473.09 g/mol.
Where can I buy Halopenium Chloride?
You can request a quote for Halopenium Chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Halopenium Chloride?
Yes, KEHONG BIO provides custom synthesis services for Halopenium Chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.