![1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea structure](/static/products/7090/709005-76-5.webp)
1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea
TL;DR: 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea (CAS 709005-76-5) is a chemical compound with molecular formula C14H13ClFN3O2S2 and molecular weight 373.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea
Also Known As: 1-(3-chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea, 4-[({[(3-chloro-4-fluorophenyl)amino]carbonothioyl}amino)methyl]benzenesulfonamide, 4-({[(3-chloro-4-fluorophenyl)carbamothioyl]amino}methyl)benzenesulfonamide, 4-({[(3-CHLORO-4-FLUOROANILINO)CARBOTHIOYL]AMINO}METHYL)-1-BENZENESULFONAMIDE, 4-[({[(3-chloro-4-fluorophenyl)amino]thioxomethyl}amino)methyl]benzenesulfonam ide
| Molecular Formula | C14H13ClFN3O2S2 |
|---|---|
| Molecular Weight | 373.01 g/mol |
| LogP | 2.6131 |
| Topological Polar Surface Area | 84.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 373.01218 |
| Heavy Atoms | 23 |
| Complexity | 826.4161 |
Chemical Identifiers
| CAS Number | 709005-76-5 |
|---|---|
| SMILES | C1=CC(=CC=C1CNC(=S)NC2=CC(=C(C=C2)F)Cl)S(=O)(=O)N |
Product Overview
1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea (CAS 709005-76-5), with molecular formula C14H13ClFN3O2S2 and molecular weight 373.01 g/mol. IUPAC: 1-(3-chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea.
Chemical Property Profile of 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea
Property Insights of 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea
The XLogP value of 2.6131 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea. The TPSA of 84.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea. Following Lipinski's Rule of Five, 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea has 3 hydrogen bond donor(s) and 3 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 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea?
The CAS number of 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea is 709005-76-5.
What is the molecular formula of 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea?
The molecular formula of 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea is C14H13ClFN3O2S2.
What is the molecular weight of 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea?
The molecular weight of 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea is 373.01 g/mol.
Where can I buy 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea?
You can request a quote for 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chloro-4-fluorophenyl)-3-[(4-sulfamoylphenyl)methyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.