3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide
TL;DR: 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide (CAS 1004035-48-6) is a chemical compound with molecular formula C14H14BrNO2S and molecular weight 338.99286 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide
Also Known As: 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide, AT-137/43420840, 3-BROMO-N-(2,4-DIMETHYL-PHENYL)-BENZENESULFONAMIDE
Technical Specifications
| Molecular Formula | C14H14BrNO2S |
| Molecular Weight | 338.99286 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.99286 Da |
| Heavy Atoms | 19 |
| Complexity | 393.0 |
| SMILES | CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC(=CC=C2)Br)C |
| InChIKey | DXTHKOUAFFHGLU-UHFFFAOYSA-N |
Chemical Property Profile of 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide
Property Insights of 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide
The XLogP value of 3.8 indicates that 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.6 Ų, 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide has 1 hydrogen bond donor(s) and 3 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-(2,4-dimethylphenyl)benzenesulfonamide?
The CAS number of 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide is 1004035-48-6.
What is the molecular formula of 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide?
The molecular formula of 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide is C14H14BrNO2S.
What is the molecular weight of 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide?
The molecular weight of 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide is 338.99286 g/mol.
Where can I buy 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide?
You can request a quote for 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide?
Yes, CoreyChem provides custom synthesis services for 3-bromo-N-(2,4-dimethylphenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.