4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide
TL;DR: 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide (CAS 347355-69-5) is a chemical compound with molecular formula C17H17ClF3N3O4S and molecular weight 451.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide
Also Known As: 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide, 4-chloro-N-(4-{[2-nitro-4-(trifluoromethyl)phenyl]amino}butyl)benzenesulfonamide, 4-chloro-N-(4-((2-nitro-4-(trifluoromethyl)phenyl)amino)butyl)benzenesulfonamide
| Molecular Formula | C17H17ClF3N3O4S |
|---|---|
| Molecular Weight | 451.06 g/mol |
| LogP | 4.4376 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 451.05804 |
| Heavy Atoms | 29 |
| Complexity | 966.87866 |
Chemical Identifiers
| CAS Number | 347355-69-5 |
|---|---|
| SMILES | C1=CC(=CC=C1S(=O)(=O)NCCCCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])Cl |
Product Overview
4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide (CAS 347355-69-5), with molecular formula C17H17ClF3N3O4S and molecular weight 451.06 g/mol. IUPAC: 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide.
Chemical Property Profile of 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide
Property Insights of 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide
The XLogP value of 4.4376 indicates that 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]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 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide. Following Lipinski's Rule of Five, 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]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 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide?
The CAS number of 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide is 347355-69-5.
What is the molecular formula of 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide?
The molecular formula of 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide is C17H17ClF3N3O4S.
What is the molecular weight of 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide?
The molecular weight of 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide is 451.06 g/mol.
Where can I buy 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide?
You can request a quote for 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-[4-[2-nitro-4-(trifluoromethyl)anilino]butyl]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.