Oxybutynin
TL;DR: Oxybutynin (CAS 5633-20-5) is a chemical compound with molecular formula C22H31NO3 and molecular weight 357.2304 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate
Also Known As: oxybutynin, Ditropan, Oxytrol, Oxybutynine, Oxybutynin chloride
Application Areas
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C22H31NO3 |
| Molecular Weight | 357.2304 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 357.2304 Da |
| Heavy Atoms | 26 |
| Complexity | 490.0 |
| Melting Point | 122-124 |
| Solubility | 50 |
| SMILES | CCN(CC)CC#CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O |
| InChIKey | XIQVNETUBQGFHX-UHFFFAOYSA-N |
Product Description
Applications: Oxybutynin is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Oxybutynin (CAS 5633-20-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Oxybutynin (CAS 5633-20-5) is a pharmaceutical intermediate with the molecular formula C22H31NO3 and a molecular weight of 357.23 g/mol. Key physical properties include a solubility: 50. It is also known as oxybutynin and Ditropan.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Oxybutynin
Property Insights of Oxybutynin
The XLogP value of 4.2 indicates that Oxybutynin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, Oxybutynin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxybutynin has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Oxybutynin?
The CAS number of Oxybutynin is 5633-20-5.
What is the molecular formula of Oxybutynin?
The molecular formula of Oxybutynin is C22H31NO3.
What is the molecular weight of Oxybutynin?
The molecular weight of Oxybutynin is 357.2304 g/mol.
What are the applications of Oxybutynin?
Oxybutynin is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Oxybutynin (CAS 5633-20-5) with custom...
Where can I buy Oxybutynin?
You can request a quote for Oxybutynin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Oxybutynin?
Yes, CoreyChem provides custom synthesis services for Oxybutynin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.