Mefenidramium Metilsulfate
TL;DR: Mefenidramium Metilsulfate (CAS 4858-60-0) is a chemical compound with molecular formula C19H27NO5S and molecular weight 381.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzhydryloxyethyl(trimethyl)azanium;methyl sulfate
Also Known As: Mefenidramium metilsulfate, Mefenidramii metilsulfas, Metilsulfato de mefenidramio, mefenidramiummetilsulfate, Mefenidramium methylsulfate
| Molecular Formula | C19H27NO5S |
|---|---|
| Molecular Weight | 381.16 g/mol |
| LogP | 2.59 |
| Topological Polar Surface Area | 84.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 381.16098 |
| Heavy Atoms | 26 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 4858-60-0 |
|---|---|
| SMILES | C[N+](C)(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2.COS(=O)(=O)[O-] |
| InChIKey | GTXRVYHDUSRDFT-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Mefenidramium Metilsulfate (CAS 4858-60-0), with molecular formula C19H27NO5S and molecular weight 381.16 g/mol. IUPAC: 2-benzhydryloxyethyl(trimethyl)azanium;methyl sulfate.
Chemical Property Profile of Mefenidramium Metilsulfate
Property Insights of Mefenidramium Metilsulfate
The XLogP value of 2.59 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mefenidramium Metilsulfate. The TPSA of 84.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Mefenidramium Metilsulfate. Following Lipinski's Rule of Five, Mefenidramium Metilsulfate 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 Mefenidramium Metilsulfate?
The CAS number of Mefenidramium Metilsulfate is 4858-60-0.
What is the molecular formula of Mefenidramium Metilsulfate?
The molecular formula of Mefenidramium Metilsulfate is C19H27NO5S.
What is the molecular weight of Mefenidramium Metilsulfate?
The molecular weight of Mefenidramium Metilsulfate is 381.16 g/mol.
Where can I buy Mefenidramium Metilsulfate?
You can request a quote for Mefenidramium Metilsulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mefenidramium Metilsulfate?
Yes, KEHONG BIO provides custom synthesis services for Mefenidramium Metilsulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.