Ketotifen
TL;DR: Ketotifen (CAS 34580-13-7) is a chemical compound with molecular formula C19H19NOS and molecular weight 309.11874 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1-methylpiperidin-4-ylidene)-6-thiatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),4,10,12-pentaen-8-one
Also Known As: ketotifen, Ketotifene, Ketotifeno, Zaditor, Ketotifenum
Application Areas
Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C19H19NOS |
| Molecular Weight | 309.11874 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 48.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 309.11874 Da |
| Heavy Atoms | 22 |
| Complexity | 476.0 |
| Melting Point | 304 to 307 °F (NTP, 1992) |
| Vapor Pressure | 4.2X10-8 mm Hg at 25 °C /Estimated/ |
| Solubility | Readily soluble |
| SMILES | CN1CCC(=C2C3=C(C(=O)CC4=CC=CC=C42)SC=C3)CC1 |
| InChIKey | ZCVMWBYGMWKGHF-UHFFFAOYSA-N |
Product Description
Applications: Ketotifen 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. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Ketotifen is a pharmaceutical intermediate identified by CAS number 34580-13-7 and the molecular formula C19H19NOS and a molecular weight of 309.12 g/mol. Physically, the compound has a solubility: Readily soluble. Synonyms include ketotifen and Ketotifene.
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 Ketotifen
Property Insights of Ketotifen
The XLogP value of 3.2 indicates that Ketotifen is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.6 Ų, Ketotifen exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ketotifen has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ketotifen?
The CAS number of Ketotifen is 34580-13-7.
What is the molecular formula of Ketotifen?
The molecular formula of Ketotifen is C19H19NOS.
What is the molecular weight of Ketotifen?
The molecular weight of Ketotifen is 309.11874 g/mol.
What are the applications of Ketotifen?
Ketotifen 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. Available from CoreyChem as both catalog item and...
Where can I buy Ketotifen?
You can request a quote for Ketotifen directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ketotifen?
Yes, CoreyChem provides custom synthesis services for Ketotifen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.