Ibuterol
TL;DR: Ibuterol (CAS 53034-85-8) is a chemical compound with molecular formula C20H31NO5 and molecular weight 365.2202 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-[2-(tert-butylamino)-1-hydroxyethyl]-5-(2-methylpropanoyloxy)phenyl] 2-methylpropanoate
Also Known As: Ibuterol, Ibuterolum, ibuterol[inn], Ibuterol [INN], Terbutalindiisobutyrat
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C20H31NO5 |
| Molecular Weight | 365.2202 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 84.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 365.2202 Da |
| Heavy Atoms | 26 |
| Complexity | 439.0 |
| SMILES | CC(C)C(=O)OC1=CC(=CC(=C1)C(CNC(C)(C)C)O)OC(=O)C(C)C |
| InChIKey | WKHOPHIMYDJVSA-UHFFFAOYSA-N |
Chemical Property Profile of Ibuterol
Property Insights of Ibuterol
The XLogP value of 3.2 indicates that Ibuterol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ibuterol. Following Lipinski's Rule of Five, Ibuterol has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ibuterol?
The CAS number of Ibuterol is 53034-85-8.
What is the molecular formula of Ibuterol?
The molecular formula of Ibuterol is C20H31NO5.
What is the molecular weight of Ibuterol?
The molecular weight of Ibuterol is 365.2202 g/mol.
Where can I buy Ibuterol?
You can request a quote for Ibuterol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ibuterol?
Yes, CoreyChem provides custom synthesis services for Ibuterol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.