Benactyzine Hydrochloride
TL;DR: Benactyzine Hydrochloride (CAS 57-37-4) is a chemical compound with molecular formula C20H26ClNO3 and molecular weight 363.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 2-hydroxy-2,2-diphenylacetate;hydrochloride
Also Known As: Benactyzine hydrochloride, Suavitil, Nutinal, Cedad, Parasan
| Molecular Formula | C20H26ClNO3 |
|---|---|
| Molecular Weight | 363.16 g/mol |
| LogP | 3.23 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 363.16013 |
| Heavy Atoms | 25 |
| Complexity | 351.0 |
| Solubility | >54.6 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 57-37-4 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.Cl |
| InChIKey | ZCEHOOLYWQBGQO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benactyzine Hydrochloride (CAS 57-37-4), with molecular formula C20H26ClNO3 and molecular weight 363.16 g/mol. IUPAC: 2-(diethylamino)ethyl 2-hydroxy-2,2-diphenylacetate;hydrochloride.
Chemical Property Profile of Benactyzine Hydrochloride
Property Insights of Benactyzine Hydrochloride
The XLogP value of 3.23 indicates that Benactyzine Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, Benactyzine Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benactyzine Hydrochloride has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benactyzine Hydrochloride?
The CAS number of Benactyzine Hydrochloride is 57-37-4.
What is the molecular formula of Benactyzine Hydrochloride?
The molecular formula of Benactyzine Hydrochloride is C20H26ClNO3.
What is the molecular weight of Benactyzine Hydrochloride?
The molecular weight of Benactyzine Hydrochloride is 363.16 g/mol.
Where can I buy Benactyzine Hydrochloride?
You can request a quote for Benactyzine Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benactyzine Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benactyzine Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.