Ebastine
TL;DR: Ebastine (CAS 90729-43-4) is a chemical compound with molecular formula C32H39NO2 and molecular weight 469.29807 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-benzhydryloxypiperidin-1-yl)-1-(4-tert-butylphenyl)butan-1-one
Also Known As: ebastine, Ebastel, Kestine, Ebastin, Ebastina
Application Areas
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C32H39NO2 |
| Molecular Weight | 469.29807 g/mol |
| XLogP | 7.2 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 469.29807 Da |
| Heavy Atoms | 35 |
| Complexity | 594.0 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCC(CC2)OC(C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | MJJALKDDGIKVBE-UHFFFAOYSA-N |
Product Description
Applications: Ebastine 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 Ebastine (CAS 90729-43-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A pharmaceutical intermediate supplied by CoreyChem, Ebastine (CAS 90729-43-4) has the molecular formula C32H39NO2 and a molecular weight of 469.3 g/mol. It is also known as ebastine and Ebastel.
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 Ebastine
Property Insights of Ebastine
The XLogP value of 7.2 indicates that Ebastine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Ebastine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ebastine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Ebastine?
The CAS number of Ebastine is 90729-43-4.
What is the molecular formula of Ebastine?
The molecular formula of Ebastine is C32H39NO2.
What is the molecular weight of Ebastine?
The molecular weight of Ebastine is 469.29807 g/mol.
What are the applications of Ebastine?
Ebastine 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 Ebastine (CAS 90729-43-4) with custom...
Where can I buy Ebastine?
You can request a quote for Ebastine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ebastine?
Yes, CoreyChem provides custom synthesis services for Ebastine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.