3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide
TL;DR: 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide (CAS 1094712-18-1) is a chemical compound with molecular formula C12H11BrN2O4S2 and molecular weight 389.93436 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide
Also Known As: 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide, N-[4-(Aminosulfonyl)phenyl]-3-bromobenzenesulfonamide
Technical Specifications
| Molecular Formula | C12H11BrN2O4S2 |
| Molecular Weight | 389.93436 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 123.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.93436 Da |
| Heavy Atoms | 21 |
| Complexity | 545.0 |
| SMILES | C1=CC(=CC(=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)S(=O)(=O)N |
| InChIKey | CCKUPSANOJCSCI-UHFFFAOYSA-N |
Chemical Property Profile of 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide
Property Insights of 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide. Following Lipinski's Rule of Five, 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide?
The CAS number of 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide is 1094712-18-1.
What is the molecular formula of 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide?
The molecular formula of 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide is C12H11BrN2O4S2.
What is the molecular weight of 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide?
The molecular weight of 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide is 389.93436 g/mol.
Where can I buy 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide?
You can request a quote for 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide?
Yes, CoreyChem provides custom synthesis services for 3-bromo-N-(4-sulfamoylphenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.