Tracazolate
TL;DR: Tracazolate (CAS 41094-88-6) is a chemical compound with molecular formula C16H24N4O2 and molecular weight 304.1899 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-(butylamino)-1-ethyl-6-methylpyrazolo[3,4-b]pyridine-5-carboxylate
Also Known As: Tracazolate, Tracazolatum, Tracazolato, Tracazolate hydrochloride, 3-Acetamidothioanisole
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H24N4O2 |
| Molecular Weight | 304.1899 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 69.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 304.1899 Da |
| Heavy Atoms | 22 |
| Complexity | 366.0 |
| SMILES | CCCCNC1=C2C=NN(C2=NC(=C1C(=O)OCC)C)CC |
| InChIKey | PCTRYMLLRKWXGF-UHFFFAOYSA-N |
Product Description
Applications: Tracazolate 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 Tracazolate (CAS 41094-88-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Tracazolate is a pharmaceutical intermediate identified by CAS number 41094-88-6 and the molecular formula C16H24N4O2 and a molecular weight of 304.19 g/mol. It is also known as Tracazolate and Tracazolatum.
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 Tracazolate
Property Insights of Tracazolate
The XLogP value of 3.5 indicates that Tracazolate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Tracazolate. Following Lipinski's Rule of Five, Tracazolate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Tracazolate?
The CAS number of Tracazolate is 41094-88-6.
What is the molecular formula of Tracazolate?
The molecular formula of Tracazolate is C16H24N4O2.
What is the molecular weight of Tracazolate?
The molecular weight of Tracazolate is 304.1899 g/mol.
What are the applications of Tracazolate?
Tracazolate 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 Tracazolate (CAS 41094-88-6) with custom...
Where can I buy Tracazolate?
You can request a quote for Tracazolate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tracazolate?
Yes, CoreyChem provides custom synthesis services for Tracazolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.