Benactyzine
TL;DR: Benactyzine (CAS 302-40-9) is a chemical compound with molecular formula C20H25NO3 and molecular weight 327.18344 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(diethylamino)ethyl 2-hydroxy-2,2-diphenylacetate
Also Known As: BENACTYZINE, Benactyzin, Diazil, Benzactyzine, Benacticina
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C20H25NO3 |
| Molecular Weight | 327.18344 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 327.18344 Da |
| Heavy Atoms | 24 |
| Complexity | 351.0 |
| Melting Point | 177-178 (Hydrochloride salt) |
| SMILES | CCN(CC)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O |
| InChIKey | IVQOFBKHQCTVQV-UHFFFAOYSA-N |
Product Description
Applications: Benactyzine 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 Benactyzine (CAS 302-40-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A pharmaceutical intermediate supplied by CoreyChem, Benactyzine (CAS 302-40-9) has the molecular formula C20H25NO3 and a molecular weight of 327.18 g/mol. It is also known as BENACTYZINE and Benactyzin.
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 Benactyzine
Property Insights of Benactyzine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benactyzine. With a topological polar surface area (TPSA) of 49.8 Ų, Benactyzine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benactyzine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benactyzine?
The CAS number of Benactyzine is 302-40-9.
What is the molecular formula of Benactyzine?
The molecular formula of Benactyzine is C20H25NO3.
What is the molecular weight of Benactyzine?
The molecular weight of Benactyzine is 327.18344 g/mol.
What are the applications of Benactyzine?
Benactyzine 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 Benactyzine (CAS 302-40-9) with custom...
Where can I buy Benactyzine?
You can request a quote for Benactyzine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benactyzine?
Yes, CoreyChem provides custom synthesis services for Benactyzine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.