N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide
TL;DR: N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide (CAS 587012-04-2) is a chemical compound with molecular formula C21H16BrFN4O2S and molecular weight 486.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(4-bromo-3-methylanilino)quinoxalin-2-yl]-4-fluorobenzenesulfonamide
Also Known As: N-[3-(4-bromo-3-methylanilino)quinoxalin-2-yl]-4-fluorobenzenesulfonamide, N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide, N-{3-[(4-bromo-3-methylphenyl)amino]quinoxalin-2-yl}-4-fluorobenzenesulfonamide, N-[(2Z)-3-[(4-bromo-3-methylphenyl)amino]quinoxalin-2(1H)-ylidene]-4-fluorobenzenesulfonamide
| Molecular Formula | C21H16BrFN4O2S |
|---|---|
| Molecular Weight | 486.02 g/mol |
| LogP | 5.38422 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 486.01614 |
| Heavy Atoms | 30 |
| Complexity | 1345.2289 |
Chemical Identifiers
| CAS Number | 587012-04-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)F)Br |
Product Overview
N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide (CAS 587012-04-2), with molecular formula C21H16BrFN4O2S and molecular weight 486.02 g/mol. IUPAC: N-[3-(4-bromo-3-methylanilino)quinoxalin-2-yl]-4-fluorobenzenesulfonamide.
Chemical Property Profile of N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide
Property Insights of N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide
The XLogP value of 5.38422 indicates that N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.98 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide. Following Lipinski's Rule of Five, N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide?
The CAS number of N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide is 587012-04-2.
What is the molecular formula of N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide?
The molecular formula of N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide is C21H16BrFN4O2S.
What is the molecular weight of N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide?
The molecular weight of N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide is 486.02 g/mol.
Where can I buy N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide?
You can request a quote for N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-((4-bromo-3-methylphenyl)amino)quinoxalin-2-yl)-4-fluorobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.