Flupirtine hydrochloride
TL;DR: Flupirtine hydrochloride (CAS 33400-45-2) is a chemical compound with molecular formula C15H18ClFN4O2 and molecular weight 340.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[2-amino-6-[(4-fluorophenyl)methylamino]-3-pyridinyl]carbamate;hydrochloride
Also Known As: Flupirtine hydrochloride, Flupirtine HCl, Flupirtine, Flupirtin hydrochlorid, Flupirtin hydrochlorid [German]
| Molecular Formula | C15H18ClFN4O2 |
|---|---|
| Molecular Weight | 340.11 g/mol |
| LogP | 3.4052 |
| Topological Polar Surface Area | 89.3 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 340.11023 |
| Heavy Atoms | 23 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 33400-45-2 |
|---|---|
| SMILES | CCOC(=O)NC1=C(N=C(C=C1)NCC2=CC=C(C=C2)F)N.Cl |
| InChIKey | WBAZQELGBFQHPE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Flupirtine hydrochloride (CAS 33400-45-2), with molecular formula C15H18ClFN4O2 and molecular weight 340.11 g/mol. IUPAC: ethyl N-[2-amino-6-[(4-fluorophenyl)methylamino]-3-pyridinyl]carbamate;hydrochloride.
Chemical Property Profile of Flupirtine hydrochloride
Property Insights of Flupirtine hydrochloride
The XLogP value of 3.4052 indicates that Flupirtine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Flupirtine hydrochloride. Following Lipinski's Rule of Five, Flupirtine hydrochloride has 4 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 Flupirtine hydrochloride?
The CAS number of Flupirtine hydrochloride is 33400-45-2.
What is the molecular formula of Flupirtine hydrochloride?
The molecular formula of Flupirtine hydrochloride is C15H18ClFN4O2.
What is the molecular weight of Flupirtine hydrochloride?
The molecular weight of Flupirtine hydrochloride is 340.11 g/mol.
Where can I buy Flupirtine hydrochloride?
You can request a quote for Flupirtine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Flupirtine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Flupirtine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.