1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene
TL;DR: 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene (CAS 1025609-87-3) is a chemical compound with molecular formula C24H24N2O5S and molecular weight 452.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-tert-butylphenyl)sulfonyl-2-nitroethenyl]-4-phenoxyaniline
Also Known As: 1-((4-(TERT-BUTYL)PHENYL)SULFONYL)-1-NITRO-2-((4-PHENOXYPHENYL)AMINO)ETHENE, N-[2-(4-tert-butylphenyl)sulfonyl-2-nitro-vinyl]-4-phenoxy-aniline, N-[2-(4-tert-butylphenyl)sulfonyl-2-nitroethenyl]-4-phenoxyaniline, N-[2-nitro-2-(4-tert-butylphenyl)sulfonyl-ethenyl]-4-phenoxy-aniline, C24H24N2O5S
| Molecular Formula | C24H24N2O5S |
|---|---|
| Molecular Weight | 452.14 g/mol |
| LogP | 5.7378 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.1406 |
| Heavy Atoms | 32 |
| Complexity | 1212.1361 |
Chemical Identifiers
| CAS Number | 1025609-87-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)C(=CNC2=CC=C(C=C2)OC3=CC=CC=C3)[N+](=O)[O-] |
Product Overview
1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene (CAS 1025609-87-3), with molecular formula C24H24N2O5S and molecular weight 452.14 g/mol. IUPAC: N-[2-(4-tert-butylphenyl)sulfonyl-2-nitroethenyl]-4-phenoxyaniline.
Chemical Property Profile of 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene
Property Insights of 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene
The XLogP value of 5.7378 indicates that 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene. Following Lipinski's Rule of Five, 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene?
The CAS number of 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene is 1025609-87-3.
What is the molecular formula of 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene?
The molecular formula of 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene is C24H24N2O5S.
What is the molecular weight of 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene?
The molecular weight of 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene is 452.14 g/mol.
Where can I buy 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene?
You can request a quote for 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene?
Yes, KEHONG BIO provides custom synthesis services for 1-((4-(Tert-butyl)phenyl)sulfonyl)-1-nitro-2-((4-phenoxyphenyl)amino)ethene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.