![N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide structure](/static/products/4454/445419-99-8.webp)
N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide
TL;DR: N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide (CAS 445419-99-8) is a chemical compound with molecular formula C16H14BrN3O4S2 and molecular weight 454.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide
Also Known As: AN-465/41168241, N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide, N-{[4-(acetylsulfamoyl)phenyl]carbamothioyl}-2-bromobenzamide, N-acetyl-4-({[(2-bromobenzoyl)amino]carbothioyl}amino)benzenesulfonamide
| Molecular Formula | C16H14BrN3O4S2 |
|---|---|
| Molecular Weight | 454.96 g/mol |
| LogP | 2.4007 |
| Topological Polar Surface Area | 104.37 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 454.9609 |
| Heavy Atoms | 26 |
| Complexity | 959.7151 |
Chemical Identifiers
| CAS Number | 445419-99-8 |
|---|---|
| SMILES | CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2Br |
Product Overview
N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide (CAS 445419-99-8), with molecular formula C16H14BrN3O4S2 and molecular weight 454.96 g/mol. IUPAC: N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide.
Chemical Property Profile of N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide
Property Insights of N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide
The XLogP value of 2.4007 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide. The TPSA of 104.37 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide. Following Lipinski's Rule of Five, N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide has 3 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 N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide?
The CAS number of N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide is 445419-99-8.
What is the molecular formula of N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide?
The molecular formula of N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide is C16H14BrN3O4S2.
What is the molecular weight of N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide?
The molecular weight of N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide is 454.96 g/mol.
Where can I buy N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide?
You can request a quote for N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-2-bromobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.