amino}benzene-1-sulfonyl fluoride structure](/static/products/2127/21278-52-4.webp)
4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride
TL;DR: 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride (CAS 21278-52-4) is a chemical compound with molecular formula C15H12ClFN2O6S and molecular weight 402.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-(2-chloro-4-nitrophenoxy)acetyl]-methylamino]benzenesulfonyl fluoride
Also Known As: 4-[[2-(2-chloro-4-nitrophenoxy)acetyl]-methylamino]benzenesu, 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride, 4-[[2-(2-chloro-4-nitrophenoxy)acetyl]-methylamino]benzenesulfonyl fluoride, 4-[2-(2-Chloro-4-nitrophenoxy)-N-methylacetamido]benzene-1-sulfonyl fluoride
| Molecular Formula | C15H12ClFN2O6S |
|---|---|
| Molecular Weight | 402.01 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.00885 |
| Heavy Atoms | 26 |
| Complexity | 615.0 |
Chemical Identifiers
| CAS Number | 21278-52-4 |
|---|---|
| SMILES | CN(C1=CC=C(C=C1)S(=O)(=O)F)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl |
| InChIKey | PPOOPIDQMNACQR-UHFFFAOYSA-N |
Product Overview
4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride (CAS 21278-52-4), with molecular formula C15H12ClFN2O6S and molecular weight 402.01 g/mol. IUPAC: 4-[[2-(2-chloro-4-nitrophenoxy)acetyl]-methylamino]benzenesulfonyl fluoride.
Chemical Property Profile of 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride
Property Insights of 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride
The XLogP value of 3.2 indicates that 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride. Following Lipinski's Rule of Five, 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride has 0 hydrogen bond donor(s) and 7 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-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride?
The CAS number of 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride is 21278-52-4.
What is the molecular formula of 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride?
The molecular formula of 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride is C15H12ClFN2O6S.
What is the molecular weight of 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride?
The molecular weight of 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride is 402.01 g/mol.
Where can I buy 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride?
You can request a quote for 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(2-Chloro-4-nitrophenoxy)acetyl](methyl)amino}benzene-1-sulfonyl fluoride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.