![2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide structure](/static/products/5285/528579-86-4.webp)
2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide
TL;DR: 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide (CAS 528579-86-4) is a chemical compound with molecular formula C16H14F3N3O5S and molecular weight 417.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide
Also Known As: 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide, N~2~-(methylsulfonyl)-N-(3-nitrophenyl)-N~2~-[3-(trifluoromethyl)phenyl]glycinamide, N-(3-NITROPHENYL)-2-{N-[3-(TRIFLUOROMETHYL)PHENYL]METHANESULFONAMIDO}ACETAMIDE
| Molecular Formula | C16H14F3N3O5S |
|---|---|
| Molecular Weight | 417.06 g/mol |
| LogP | 3.0183 |
| Topological Polar Surface Area | 109.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.06064 |
| Heavy Atoms | 28 |
| Complexity | 1008.5796 |
Chemical Identifiers
| CAS Number | 528579-86-4 |
|---|---|
| SMILES | CS(=O)(=O)N(CC(=O)NC1=CC(=CC=C1)[N+](=O)[O-])C2=CC=CC(=C2)C(F)(F)F |
Product Overview
2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide (CAS 528579-86-4), with molecular formula C16H14F3N3O5S and molecular weight 417.06 g/mol. IUPAC: 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide.
Chemical Property Profile of 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide
Property Insights of 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide
The XLogP value of 3.0183 indicates that 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide. Following Lipinski's Rule of Five, 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide has 1 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 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide?
The CAS number of 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide is 528579-86-4.
What is the molecular formula of 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide?
The molecular formula of 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide is C16H14F3N3O5S.
What is the molecular weight of 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide?
The molecular weight of 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide is 417.06 g/mol.
Where can I buy 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide?
You can request a quote for 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(3-nitrophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.