Trigevolol mesylate
TL;DR: Trigevolol mesylate (CAS 104393-02-4) is a chemical compound with molecular formula C22H32N2O10S and molecular weight 516.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-5-[2-[[2-hydroxy-3-[4-(2-methoxyethoxy)phenoxy]propyl]amino]ethoxy]benzamide;methanesulfonic acid
Also Known As: trigevolol mesylate, Cgp 1758b, CGP-1758 monomethanesulfonate, CGP-1758B, (2-phenylmethoxyphenyl)methanamine
| Molecular Formula | C22H32N2O10S |
|---|---|
| Molecular Weight | 516.18 g/mol |
| LogP | 0.4286 |
| Topological Polar Surface Area | 195.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 14 |
| Exact Mass | 516.1778 |
| Heavy Atoms | 35 |
| Complexity | 567.0 |
Chemical Identifiers
| CAS Number | 104393-02-4 |
|---|---|
| SMILES | COCCOC1=CC=C(C=C1)OCC(CNCCOC2=CC(=C(C=C2)O)C(=O)N)O.CS(=O)(=O)O |
| InChIKey | DXYKRAKKHMPKTD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trigevolol mesylate (CAS 104393-02-4), with molecular formula C22H32N2O10S and molecular weight 516.18 g/mol. IUPAC: 2-hydroxy-5-[2-[[2-hydroxy-3-[4-(2-methoxyethoxy)phenoxy]propyl]amino]ethoxy]benzamide;methanesulfonic acid.
Chemical Property Profile of Trigevolol mesylate
Property Insights of Trigevolol mesylate
The XLogP value of 0.4286 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trigevolol mesylate. The TPSA of 195.0 Ų indicates high polarity, suggesting Trigevolol mesylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Trigevolol mesylate has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Trigevolol mesylate?
The CAS number of Trigevolol mesylate is 104393-02-4.
What is the molecular formula of Trigevolol mesylate?
The molecular formula of Trigevolol mesylate is C22H32N2O10S.
What is the molecular weight of Trigevolol mesylate?
The molecular weight of Trigevolol mesylate is 516.18 g/mol.
Where can I buy Trigevolol mesylate?
You can request a quote for Trigevolol mesylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trigevolol mesylate?
Yes, KEHONG BIO provides custom synthesis services for Trigevolol mesylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.