Rac-Efavirenz
TL;DR: Rac-Efavirenz (CAS 177530-93-7) is a chemical compound with molecular formula C14H9ClF3NO2 and molecular weight 315.0274 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-chloro-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one
Also Known As: Rac-Efavirenz, efavirenz, rac Efavirenz, Efavirenz Racemic, (Rac)-Efavirenz
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H9ClF3NO2 |
| Molecular Weight | 315.0274 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 315.0274 Da |
| Heavy Atoms | 21 |
| Complexity | 519.0 |
| Solubility | 19.6 [ug/mL] (The mean of the results at pH 7.4) |
| SMILES | C1CC1C#CC2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F |
| InChIKey | XPOQHMRABVBWPR-UHFFFAOYSA-N |
Product Description
Applications: Rac-Efavirenz 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).
A pharmaceutical intermediate supplied by CoreyChem, Rac-Efavirenz (CAS 177530-93-7) has the molecular formula C14H9ClF3NO2 and a molecular weight of 315.03 g/mol. Reported properties include a solubility: 19.6 [ug/mL] (The mean of the results at pH 7.4). Synonyms include Rac-Efavirenz and efavirenz.
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 Rac-Efavirenz
Property Insights of Rac-Efavirenz
The XLogP value of 4.0 indicates that Rac-Efavirenz is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Rac-Efavirenz exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Rac-Efavirenz 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 Rac-Efavirenz?
The CAS number of Rac-Efavirenz is 177530-93-7.
What is the molecular formula of Rac-Efavirenz?
The molecular formula of Rac-Efavirenz is C14H9ClF3NO2.
What is the molecular weight of Rac-Efavirenz?
The molecular weight of Rac-Efavirenz is 315.0274 g/mol.
What are the applications of Rac-Efavirenz?
Rac-Efavirenz 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 Rac-Efavirenz?
You can request a quote for Rac-Efavirenz directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Rac-Efavirenz?
Yes, CoreyChem provides custom synthesis services for Rac-Efavirenz and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.