Flubanilate Hydrochloride
TL;DR: Flubanilate Hydrochloride (CAS 967-48-6) is a chemical compound with molecular formula C14H20ClF3N2O2 and molecular weight 340.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[2-(dimethylamino)ethyl]-N-[3-(trifluoromethyl)phenyl]carbamate;hydrochloride
Also Known As: Flubanilate hydrochloride, Flubanilate HCl, Flubanilate hydrochloride [USAN], Flubanilate hydrochloride (USAN), Ethyl N-(2-(dimethylamino)ethyl)-m-(trifluoromethyl)carbanilate monohydrochloride
| Molecular Formula | C14H20ClF3N2O2 |
|---|---|
| Molecular Weight | 340.12 g/mol |
| LogP | 3.6517 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 340.11655 |
| Heavy Atoms | 22 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 967-48-6 |
|---|---|
| SMILES | CCOC(=O)N(CCN(C)C)C1=CC=CC(=C1)C(F)(F)F.Cl |
| InChIKey | YLVGWMCQIWELEA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Flubanilate Hydrochloride (CAS 967-48-6), with molecular formula C14H20ClF3N2O2 and molecular weight 340.12 g/mol. IUPAC: ethyl N-[2-(dimethylamino)ethyl]-N-[3-(trifluoromethyl)phenyl]carbamate;hydrochloride.
Chemical Property Profile of Flubanilate Hydrochloride
Property Insights of Flubanilate Hydrochloride
The XLogP value of 3.6517 indicates that Flubanilate Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, Flubanilate Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Flubanilate Hydrochloride has 1 hydrogen bond donor(s) and 6 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 Flubanilate Hydrochloride?
The CAS number of Flubanilate Hydrochloride is 967-48-6.
What is the molecular formula of Flubanilate Hydrochloride?
The molecular formula of Flubanilate Hydrochloride is C14H20ClF3N2O2.
What is the molecular weight of Flubanilate Hydrochloride?
The molecular weight of Flubanilate Hydrochloride is 340.12 g/mol.
Where can I buy Flubanilate Hydrochloride?
You can request a quote for Flubanilate Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Flubanilate Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Flubanilate Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.