TL;DR: Trigevolol mesylate (CAS 104393-02-4) is a chemical compound with molecular formula C22H32N2O10S and molecular weight 516.1778 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
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
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C22H32N2O10S |
| Molecular Weight | 516.1778 g/mol |
| XLogP | 0.4286 |
| Topological Polar Surface Area (TPSA) | 195.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 14 |
| Exact Mass | 516.1778 Da |
| Heavy Atoms | 35 |
| Complexity | 567.0 |
| 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 |
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.
The CAS number of Trigevolol mesylate is 104393-02-4.
The molecular formula of Trigevolol mesylate is C22H32N2O10S.
The molecular weight of Trigevolol mesylate is 516.1778 g/mol.
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