Teflutixol
TL;DR: Teflutixol (CAS 55837-23-5) is a chemical compound with molecular formula C23H26F4N2OS and molecular weight 454.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[3-[6-fluoro-2-(trifluoromethyl)-9H-thioxanthen-9-yl]propyl]piperazin-1-yl]ethanol
Also Known As: Teflutixol, Teflutixolum, Teflutixol [INN], teflutixol[inn], Tefluxitol
| Molecular Formula | C23H26F4N2OS |
|---|---|
| Molecular Weight | 454.17 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 454.1702 |
| Heavy Atoms | 31 |
| Complexity | 572.0 |
Chemical Identifiers
| CAS Number | 55837-23-5 |
|---|---|
| SMILES | C1CN(CCN1CCCC2C3=C(C=C(C=C3)F)SC4=C2C=C(C=C4)C(F)(F)F)CCO |
| InChIKey | BJWAPFORUPUXRJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Teflutixol (CAS 55837-23-5), with molecular formula C23H26F4N2OS and molecular weight 454.17 g/mol. IUPAC: 2-[4-[3-[6-fluoro-2-(trifluoromethyl)-9H-thioxanthen-9-yl]propyl]piperazin-1-yl]ethanol.
Chemical Property Profile of Teflutixol
Property Insights of Teflutixol
The XLogP value of 4.6 indicates that Teflutixol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.0 Ų, Teflutixol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Teflutixol has 1 hydrogen bond donor(s) and 8 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 Teflutixol?
The CAS number of Teflutixol is 55837-23-5.
What is the molecular formula of Teflutixol?
The molecular formula of Teflutixol is C23H26F4N2OS.
What is the molecular weight of Teflutixol?
The molecular weight of Teflutixol is 454.17 g/mol.
Where can I buy Teflutixol?
You can request a quote for Teflutixol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Teflutixol?
Yes, KEHONG BIO provides custom synthesis services for Teflutixol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.