Fluorbenside
TL;DR: Fluorbenside (CAS 405-30-1) is a chemical compound with molecular formula C13H10ClFS and molecular weight 252.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-[(4-fluorophenyl)sulfanylmethyl]benzene
Also Known As: FLUORBENSIDE, Fluoroparacide, Fluorparacide, Fluorosulphacide, Fluorsulphacide
| Molecular Formula | C13H10ClFS |
|---|---|
| Molecular Weight | 252.02 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.01758 |
| Heavy Atoms | 16 |
| Complexity | 196.0 |
| Melting Point | 36 °C |
| Solubility | INSOL IN WATER; SOL IN ACETONE & OILS |
| Vapor Pressure | 0.0000828 [mmHg] |
Chemical Identifiers
| CAS Number | 405-30-1 |
|---|---|
| SMILES | C1=CC(=CC=C1CSC2=CC=C(C=C2)F)Cl |
| InChIKey | GBZXOIUBLKUSJR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Fluorbenside (CAS 405-30-1), with molecular formula C13H10ClFS and molecular weight 252.02 g/mol. IUPAC: 1-chloro-4-[(4-fluorophenyl)sulfanylmethyl]benzene.
Chemical Property Profile of Fluorbenside
Property Insights of Fluorbenside
The XLogP value of 4.7 indicates that Fluorbenside is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, Fluorbenside exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Fluorbenside has 0 hydrogen bond donor(s) and 2 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 Fluorbenside?
The CAS number of Fluorbenside is 405-30-1.
What is the molecular formula of Fluorbenside?
The molecular formula of Fluorbenside is C13H10ClFS.
What is the molecular weight of Fluorbenside?
The molecular weight of Fluorbenside is 252.02 g/mol.
Where can I buy Fluorbenside?
You can request a quote for Fluorbenside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fluorbenside?
Yes, KEHONG BIO provides custom synthesis services for Fluorbenside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.