3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide
TL;DR: 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide (CAS 1040016-39-4) is a chemical compound with molecular formula C15H14BrNO3S and molecular weight 366.9878 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide
Also Known As: 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide, 3-Acetyl-N-(4-bromo-2-methylphenyl)benzene-1-sulfonamide
Technical Specifications
| Molecular Formula | C15H14BrNO3S |
| Molecular Weight | 366.9878 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 71.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.9878 Da |
| Heavy Atoms | 21 |
| Complexity | 474.0 |
| SMILES | CC1=C(C=CC(=C1)Br)NS(=O)(=O)C2=CC=CC(=C2)C(=O)C |
| InChIKey | CUWKDPVUIHCWKQ-UHFFFAOYSA-N |
Chemical Property Profile of 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide
Property Insights of 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide
The XLogP value of 3.1 indicates that 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide. Following Lipinski's Rule of Five, 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide has 1 hydrogen bond donor(s) and 4 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-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide?
The CAS number of 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide is 1040016-39-4.
What is the molecular formula of 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide?
The molecular formula of 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide is C15H14BrNO3S.
What is the molecular weight of 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide?
The molecular weight of 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide is 366.9878 g/mol.
Where can I buy 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide?
You can request a quote for 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide?
Yes, CoreyChem provides custom synthesis services for 3-acetyl-N-(4-bromo-2-methylphenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.