N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine
TL;DR: N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine (CAS 394-79-6) is a chemical compound with molecular formula C17H11F3N2O4S and molecular weight 396.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]naphthalen-1-amine
Also Known As: N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine, N-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]naphthalen-1-amine, N-{2-nitro-4-[(trifluoromethyl)sulfonyl]phenyl}naphthalen-1-amine
| Molecular Formula | C17H11F3N2O4S |
|---|---|
| Molecular Weight | 396.04 g/mol |
| LogP | 4.7851 |
| Topological Polar Surface Area | 89.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 396.03915 |
| Heavy Atoms | 27 |
| Complexity | 1139.1189 |
Chemical Identifiers
| CAS Number | 394-79-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2NC3=C(C=C(C=C3)S(=O)(=O)C(F)(F)F)[N+](=O)[O-] |
Product Overview
N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine (CAS 394-79-6), with molecular formula C17H11F3N2O4S and molecular weight 396.04 g/mol. IUPAC: N-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]naphthalen-1-amine.
Chemical Property Profile of N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine
Property Insights of N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine
The XLogP value of 4.7851 indicates that N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.31 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine. Following Lipinski's Rule of Five, N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine 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 N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine?
The CAS number of N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine is 394-79-6.
What is the molecular formula of N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine?
The molecular formula of N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine is C17H11F3N2O4S.
What is the molecular weight of N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine?
The molecular weight of N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine is 396.04 g/mol.
Where can I buy N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine?
You can request a quote for N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-nitro-4-((trifluoromethyl)sulfonyl)phenyl)naphthalen-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.