![3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide structure](/static/products/5917/591726-60-2.webp)
3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide
TL;DR: 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide (CAS 591726-60-2) is a chemical compound with molecular formula C15H12Cl2F3N3O4S and molecular weight 456.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide
Also Known As: 3,4-dichloro-N-(2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}ethyl)benzenesulfonamide, 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide, 3,4-dichloro-N-(2-((2-nitro-4-(trifluoromethyl)phenyl)amino)ethyl)benzenesulfonamide, 3,4-dichloro-N-[2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]ethyl]benzenesulfonamide
| Molecular Formula | C15H12Cl2F3N3O4S |
|---|---|
| Molecular Weight | 456.99 g/mol |
| LogP | 4.3108 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 456.98776 |
| Heavy Atoms | 28 |
| Complexity | 1000.511 |
Chemical Identifiers
| CAS Number | 591726-60-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NCCNS(=O)(=O)C2=CC(=C(C=C2)Cl)Cl |
Product Overview
3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide (CAS 591726-60-2), with molecular formula C15H12Cl2F3N3O4S and molecular weight 456.99 g/mol. IUPAC: 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide.
Chemical Property Profile of 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide
Property Insights of 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide
The XLogP value of 4.3108 indicates that 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide. Following Lipinski's Rule of Five, 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide has 2 hydrogen bond donor(s) and 5 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 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide?
The CAS number of 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide is 591726-60-2.
What is the molecular formula of 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide?
The molecular formula of 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide is C15H12Cl2F3N3O4S.
What is the molecular weight of 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide?
The molecular weight of 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide is 456.99 g/mol.
Where can I buy 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide?
You can request a quote for 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dichloro-N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.