![2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide structure](/static/products/5011/501111-82-6.webp)
2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide
TL;DR: 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide (CAS 501111-82-6) is a chemical compound with molecular formula C18H20BrN3O3S2 and molecular weight 469.01294 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide
Also Known As: 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide, 2-bromo-N-{[4-(diethylsulfamoyl)phenyl]carbamothioyl}benzamide, 2-bromo-N-[({4-[(diethylamino)sulfonyl]phenyl}amino)carbonothioyl]benzamide
Technical Specifications
| Molecular Formula | C18H20BrN3O3S2 |
| Molecular Weight | 469.01294 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 469.01294 Da |
| Heavy Atoms | 27 |
| Complexity | 612.0 |
| SMILES | CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2Br |
| InChIKey | NMKDSBFSVUETKY-UHFFFAOYSA-N |
Chemical Property Profile of 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide
Property Insights of 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide
The XLogP value of 4.1 indicates that 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide. Following Lipinski's Rule of Five, 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide 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
What is the CAS number of 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide?
The CAS number of 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide is 501111-82-6.
What is the molecular formula of 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide?
The molecular formula of 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide is C18H20BrN3O3S2.
What is the molecular weight of 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide?
The molecular weight of 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide is 469.01294 g/mol.
Where can I buy 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide?
You can request a quote for 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide?
Yes, CoreyChem provides custom synthesis services for 2-bromo-N-[[4-(diethylsulfamoyl)phenyl]carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.