利鲁唑
TL;DR: 利鲁唑 (CAS 1744-22-5) is a chemical compound with molecular formula C8H5F3N2OS and molecular weight 234.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
利鲁唑
6-(trifluoromethoxy)-1,3-benzothiazol-2-amine
Also Known As: riluzole, Rilutek, Riluzol, Riluzolum, Tiglutik
| Molecular Formula | C8H5F3N2OS |
|---|---|
| Molecular Weight | 234.01 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 76.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 234.00746 |
| Heavy Atoms | 15 |
| Complexity | 238.0 |
| Melting Point | 119 |
| Solubility | 3.95e-02 g/L |
Chemical Identifiers
| CAS Number | 1744-22-5 |
|---|---|
| SMILES | C1=CC2=C(C=C1OC(F)(F)F)SC(=N2)N |
| InChIKey | FTALBRSUTCGOEG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
利鲁唑 (CAS 1744-22-5), with molecular formula C8H5F3N2OS and molecular weight 234.01 g/mol. IUPAC: 6-(trifluoromethoxy)-1,3-benzothiazol-2-amine.
Chemical Property Profile of 利鲁唑
Property Insights of 利鲁唑
The XLogP value of 3.6 indicates that 利鲁唑 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 利鲁唑. Following Lipinski's Rule of Five, 利鲁唑 has 1 hydrogen bond donor(s) and 7 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 利鲁唑?
The CAS number of 利鲁唑 is 1744-22-5.
What is the molecular formula of 利鲁唑?
The molecular formula of 利鲁唑 is C8H5F3N2OS.
What is the molecular weight of 利鲁唑?
The molecular weight of 利鲁唑 is 234.01 g/mol.
Where can I buy 利鲁唑?
You can request a quote for 利鲁唑 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 利鲁唑?
Yes, KEHONG BIO provides custom synthesis services for 利鲁唑 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.