4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide
TL;DR: 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide (CAS 708240-95-3) is a chemical compound with molecular formula C17H19FN4O4S3 and molecular weight 458.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide
Also Known As: 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide, 4-[({4-[(4-fluorophenyl)sulfonyl]piperazinyl}thioxomethyl)amino]benzenesulfona mide, 4-[(4-fluorophenyl)sulfonyl]-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide, N-[4-(aminosulfonyl)phenyl]-4-[(4-fluorophenyl)sulfonyl]-1-piperazinecarbothioamide
| Molecular Formula | C17H19FN4O4S3 |
|---|---|
| Molecular Weight | 458.06 g/mol |
| LogP | 1.1764 |
| Topological Polar Surface Area | 112.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 458.05524 |
| Heavy Atoms | 29 |
| Complexity | 1096.372 |
Chemical Identifiers
| CAS Number | 708240-95-3 |
|---|---|
| SMILES | C1CN(CCN1C(=S)NC2=CC=C(C=C2)S(=O)(=O)N)S(=O)(=O)C3=CC=C(C=C3)F |
Product Overview
4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide (CAS 708240-95-3), with molecular formula C17H19FN4O4S3 and molecular weight 458.06 g/mol. IUPAC: 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide.
Chemical Property Profile of 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide
Property Insights of 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide
The XLogP value of 1.1764 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide. The TPSA of 112.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide. Following Lipinski's Rule of Five, 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide has 2 hydrogen bond donor(s) and 5 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 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide?
The CAS number of 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide is 708240-95-3.
What is the molecular formula of 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide?
The molecular formula of 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide is C17H19FN4O4S3.
What is the molecular weight of 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide?
The molecular weight of 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide is 458.06 g/mol.
Where can I buy 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide?
You can request a quote for 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-fluorophenyl)sulfonyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.