Methohexital
TL;DR: Methohexital (CAS 151-83-7) is a chemical compound with molecular formula C14H18N2O3 and molecular weight 262.13174 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-hex-3-yn-2-yl-1-methyl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
Also Known As: METHOHEXITAL, Methohexitone, Methodrexitone, Enallynymall, Metohexital
Application Areas
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H18N2O3 |
| Molecular Weight | 262.13174 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 66.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.13174 Da |
| Heavy Atoms | 19 |
| Complexity | 497.0 |
| Solubility | 5.24e-02 g/L |
| SMILES | CCC#CC(C)C1(C(=O)NC(=O)N(C1=O)C)CC=C |
| InChIKey | NZXKDOXHBHYTKP-UHFFFAOYSA-N |
Product Description
Applications: Methohexital 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).
Methohexital is a pharmaceutical intermediate identified by CAS number 151-83-7 and the molecular formula C14H18N2O3 and a molecular weight of 262.13 g/mol. Physically, the compound has a solubility: 5.24e-02 g/L. Synonyms include METHOHEXITAL and Methohexitone.
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 Methohexital
Property Insights of Methohexital
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methohexital. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Methohexital. Following Lipinski's Rule of Five, Methohexital has 1 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 Methohexital?
The CAS number of Methohexital is 151-83-7.
What is the molecular formula of Methohexital?
The molecular formula of Methohexital is C14H18N2O3.
What is the molecular weight of Methohexital?
The molecular weight of Methohexital is 262.13174 g/mol.
What are the applications of Methohexital?
Methohexital 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 Methohexital?
You can request a quote for Methohexital directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methohexital?
Yes, CoreyChem provides custom synthesis services for Methohexital and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.