![N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide structure](/static/products/4417/4417-93-0.webp)
N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide
TL;DR: N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide (CAS 4417-93-0) is a chemical compound with molecular formula C16H16F3N3O4S and molecular weight 403.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide
Also Known As: Butyryl-guanidin, N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide, N-(2-{[2-nitro-4-(trifluoromethyl)phenyl]amino}ethyl)-1-phenylmethanesulfonamide, N-[2-[[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]AMINO]ETHYL]-1-PHENYL-METHANESULFONAMIDE, N-{2-[2-Nitro-4-(trifluoromethyl)anilino]ethyl}-1-phenylmethanesulfonamide
| Molecular Formula | C16H16F3N3O4S |
|---|---|
| Molecular Weight | 403.08 g/mol |
| LogP | 3.1451 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 403.08136 |
| Heavy Atoms | 27 |
| Complexity | 902.87164 |
Chemical Identifiers
| CAS Number | 4417-93-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CS(=O)(=O)NCCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-] |
Product Overview
N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide (CAS 4417-93-0), with molecular formula C16H16F3N3O4S and molecular weight 403.08 g/mol. IUPAC: N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide.
Chemical Property Profile of N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide
Property Insights of N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide
The XLogP value of 3.1451 indicates that N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide 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 N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide. Following Lipinski's Rule of Five, N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide 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 N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide?
The CAS number of N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide is 4417-93-0.
What is the molecular formula of N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide?
The molecular formula of N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide is C16H16F3N3O4S.
What is the molecular weight of N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide?
The molecular weight of N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide is 403.08 g/mol.
Where can I buy N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide?
You can request a quote for N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-[2-nitro-4-(trifluoromethyl)anilino]ethyl]-1-phenylmethanesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.