4-Bromo-N,N-dimethylbenzenesulphonamide
TL;DR: 4-Bromo-N,N-dimethylbenzenesulphonamide (CAS 707-60-8) is a chemical compound with molecular formula C8H10BrNO2S and molecular weight 262.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N,N-dimethylbenzenesulfonamide
Also Known As: 4-Bromo-N,N-dimethylbenzenesulfonamide, 4-Bromo-N,N-DiMethyl-Benzenesulfonamide, p-Bromo-N,N-dimethylbenzenesulfonamide, 2,3,4-Trifluoroaniline, n,n-dimethyl 4-bromobenzenesulfonamide
| Molecular Formula | C8H10BrNO2S |
|---|---|
| Molecular Weight | 262.96 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.96155 |
| Heavy Atoms | 13 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 707-60-8 |
|---|---|
| SMILES | CN(C)S(=O)(=O)C1=CC=C(C=C1)Br |
| InChIKey | NQAUNPZZVCXYEJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Bromo-N,N-dimethylbenzenesulphonamide (CAS 707-60-8), with molecular formula C8H10BrNO2S and molecular weight 262.96 g/mol. IUPAC: 4-bromo-N,N-dimethylbenzenesulfonamide.
Chemical Property Profile of 4-Bromo-N,N-dimethylbenzenesulphonamide
Property Insights of 4-Bromo-N,N-dimethylbenzenesulphonamide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-N,N-dimethylbenzenesulphonamide. With a topological polar surface area (TPSA) of 45.8 Ų, 4-Bromo-N,N-dimethylbenzenesulphonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-N,N-dimethylbenzenesulphonamide has 0 hydrogen bond donor(s) and 3 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 4-Bromo-N,N-dimethylbenzenesulphonamide?
The CAS number of 4-Bromo-N,N-dimethylbenzenesulphonamide is 707-60-8.
What is the molecular formula of 4-Bromo-N,N-dimethylbenzenesulphonamide?
The molecular formula of 4-Bromo-N,N-dimethylbenzenesulphonamide is C8H10BrNO2S.
What is the molecular weight of 4-Bromo-N,N-dimethylbenzenesulphonamide?
The molecular weight of 4-Bromo-N,N-dimethylbenzenesulphonamide is 262.96 g/mol.
Where can I buy 4-Bromo-N,N-dimethylbenzenesulphonamide?
You can request a quote for 4-Bromo-N,N-dimethylbenzenesulphonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-N,N-dimethylbenzenesulphonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-N,N-dimethylbenzenesulphonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.