Tomelukast
TL;DR: Tomelukast (CAS 88107-10-2) is a chemical compound with molecular formula C16H22N4O3 and molecular weight 318.1692 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-hydroxy-3-propyl-4-[4-(2H-tetrazol-5-yl)butoxy]phenyl]ethanone
Also Known As: Tomelukast, Tomelukastum, LY 171883, Tomelukastum [INN-Latin], Compound LY171883
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H22N4O3 |
| Molecular Weight | 318.1692 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 318.1692 Da |
| Heavy Atoms | 23 |
| Complexity | 369.0 |
| SMILES | CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCC2=NNN=N2 |
| InChIKey | MWYHLEQJTQJHSS-UHFFFAOYSA-N |
Product Description
Applications: Tomelukast is used in pharmaceutical synthesis routes and API production, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Tomelukast (CAS 88107-10-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Tomelukast (CAS 88107-10-2) is a pharmaceutical intermediate with the molecular formula C16H22N4O3 and a molecular weight of 318.17 g/mol. It is also known as Tomelukast and Tomelukastum.
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 Tomelukast
Property Insights of Tomelukast
The XLogP value of 3.7 indicates that Tomelukast is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Tomelukast. Following Lipinski's Rule of Five, Tomelukast 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 Tomelukast?
The CAS number of Tomelukast is 88107-10-2.
What is the molecular formula of Tomelukast?
The molecular formula of Tomelukast is C16H22N4O3.
What is the molecular weight of Tomelukast?
The molecular weight of Tomelukast is 318.1692 g/mol.
What are the applications of Tomelukast?
Tomelukast is used in pharmaceutical synthesis routes and API production, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Tomelukast (CAS 88107-10-2) with custom...
Where can I buy Tomelukast?
You can request a quote for Tomelukast directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tomelukast?
Yes, CoreyChem provides custom synthesis services for Tomelukast and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.