Nisbuterol Mesylate
TL;DR: Nisbuterol Mesylate (CAS 60734-88-5) is a chemical compound with molecular formula C23H31NO9S and molecular weight 497.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-acetyloxy-4-[2-(tert-butylamino)-1-hydroxyethyl]phenyl] 4-methoxybenzoate;methanesulfonic acid
Also Known As: Nisbuterol mesylate, Nisbuterol mesilate, Nisbuterol mesylate [USAN], Win 34886, Nisbuterol mesylate (USAN)
| Molecular Formula | C23H31NO9S |
|---|---|
| Molecular Weight | 497.17 g/mol |
| LogP | 2.7652 |
| Topological Polar Surface Area | 148.46 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 497.17197 |
| Heavy Atoms | 34 |
| Complexity | 1066.6099 |
Chemical Identifiers
| CAS Number | 60734-88-5 |
|---|---|
| SMILES | CC(=O)OC1=C(C=CC(=C1)C(CNC(C)(C)C)O)OC(=O)C2=CC=C(C=C2)OC.CS(=O)(=O)O |
Product Overview
Nisbuterol Mesylate (CAS 60734-88-5), with molecular formula C23H31NO9S and molecular weight 497.17 g/mol. IUPAC: [2-acetyloxy-4-[2-(tert-butylamino)-1-hydroxyethyl]phenyl] 4-methoxybenzoate;methanesulfonic acid.
Chemical Property Profile of Nisbuterol Mesylate
Property Insights of Nisbuterol Mesylate
The XLogP value of 2.7652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nisbuterol Mesylate. The TPSA of 148.46 Ų indicates high polarity, suggesting Nisbuterol Mesylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Nisbuterol Mesylate has 3 hydrogen bond donor(s) and 9 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 Nisbuterol Mesylate?
The CAS number of Nisbuterol Mesylate is 60734-88-5.
What is the molecular formula of Nisbuterol Mesylate?
The molecular formula of Nisbuterol Mesylate is C23H31NO9S.
What is the molecular weight of Nisbuterol Mesylate?
The molecular weight of Nisbuterol Mesylate is 497.17 g/mol.
Where can I buy Nisbuterol Mesylate?
You can request a quote for Nisbuterol Mesylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nisbuterol Mesylate?
Yes, KEHONG BIO provides custom synthesis services for Nisbuterol Mesylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.