Gaboxadol
TL;DR: Gaboxadol (CAS 64603-91-4) is a chemical compound with molecular formula C6H8N2O2 and molecular weight 140.05858 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridin-3-one
Also Known As: gaboxadol, THIP, Gaboxadolum, THIP hydrochloride, Gaboxadolum [Latin]
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H8N2O2 |
| Molecular Weight | 140.05858 g/mol |
| XLogP | -0.9 |
| Topological Polar Surface Area (TPSA) | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.05858 Da |
| Heavy Atoms | 10 |
| Complexity | 210.0 |
| SMILES | C1CNCC2=C1C(=O)NO2 |
| InChIKey | ZXRVKCBLGJOCEE-UHFFFAOYSA-N |
Product Description
Applications: Gaboxadol 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 Gaboxadol (CAS 64603-91-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Gaboxadol (CAS 64603-91-4) is a pharmaceutical intermediate with the molecular formula C6H8N2O2 and a molecular weight of 140.06 g/mol. It is also known as gaboxadol and THIP.
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 Gaboxadol
Property Insights of Gaboxadol
The XLogP value of -0.9 indicates that Gaboxadol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 50.4 Ų, Gaboxadol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Gaboxadol has 2 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 Gaboxadol?
The CAS number of Gaboxadol is 64603-91-4.
What is the molecular formula of Gaboxadol?
The molecular formula of Gaboxadol is C6H8N2O2.
What is the molecular weight of Gaboxadol?
The molecular weight of Gaboxadol is 140.05858 g/mol.
What are the applications of Gaboxadol?
Gaboxadol 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 Gaboxadol (CAS 64603-91-4) with custom...
Where can I buy Gaboxadol?
You can request a quote for Gaboxadol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Gaboxadol?
Yes, CoreyChem provides custom synthesis services for Gaboxadol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.