Isoetharine Mesylate
TL;DR: Isoetharine Mesylate (CAS 7279-75-6) is a chemical compound with molecular formula C14H25NO6S and molecular weight 335.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol;methanesulfonic acid
Also Known As: ISOETHARINE MESYLATE, Isoetharine mesylate salt, Bronkometer, Isotharine mesylate, Isoetarine mesilate
| Molecular Formula | C14H25NO6S |
|---|---|
| Molecular Weight | 335.14 g/mol |
| LogP | 1.41 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.14026 |
| Heavy Atoms | 22 |
| Complexity | 315.0 |
| Solubility | >50.3 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 7279-75-6 |
|---|---|
| SMILES | CCC(C(C1=CC(=C(C=C1)O)O)O)NC(C)C.CS(=O)(=O)O |
| InChIKey | SOYAGMVKMXZVNZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isoetharine Mesylate (CAS 7279-75-6), with molecular formula C14H25NO6S and molecular weight 335.14 g/mol. IUPAC: 4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol;methanesulfonic acid.
Chemical Property Profile of Isoetharine Mesylate
Property Insights of Isoetharine Mesylate
The XLogP value of 1.41 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isoetharine Mesylate. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Isoetharine Mesylate. Following Lipinski's Rule of Five, Isoetharine Mesylate has 5 hydrogen bond donor(s) and 7 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 Isoetharine Mesylate?
The CAS number of Isoetharine Mesylate is 7279-75-6.
What is the molecular formula of Isoetharine Mesylate?
The molecular formula of Isoetharine Mesylate is C14H25NO6S.
What is the molecular weight of Isoetharine Mesylate?
The molecular weight of Isoetharine Mesylate is 335.14 g/mol.
Where can I buy Isoetharine Mesylate?
You can request a quote for Isoetharine Mesylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoetharine Mesylate?
Yes, KEHONG BIO provides custom synthesis services for Isoetharine Mesylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.