2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE
TL;DR: 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE (CAS 1025617-12-2) is a chemical compound with molecular formula C16H9BrF6N2O4S and molecular weight 517.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-bromophenyl)sulfonyl-2-nitroethenyl]-3,5-bis(trifluoromethyl)aniline
Also Known As: 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE, N-[2-(4-bromobenzenesulfonyl)-2-nitroethenyl]-3,5-bis(trifluoromethyl)aniline, N-[2-(4-bromophenyl)sulfonyl-2-nitro-ethenyl]-3,5-bis(trifluoromethyl)aniline, N-[2-(4-bromophenyl)sulfonyl-2-nitro-vinyl]-3,5-bis(trifluoromethyl)aniline, N-[2-(4-bromophenyl)sulfonyl-2-nitroethenyl]-3,5-bis(trifluoromethyl)aniline
| Molecular Formula | C16H9BrF6N2O4S |
|---|---|
| Molecular Weight | 517.94 g/mol |
| LogP | 5.4481 |
| Topological Polar Surface Area | 89.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 517.9371 |
| Heavy Atoms | 30 |
| Complexity | 1063.9489 |
Chemical Identifiers
| CAS Number | 1025617-12-2 |
|---|---|
| SMILES | C1=CC(=CC=C1S(=O)(=O)C(=CNC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)[N+](=O)[O-])Br |
Product Overview
2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE (CAS 1025617-12-2), with molecular formula C16H9BrF6N2O4S and molecular weight 517.94 g/mol. IUPAC: N-[2-(4-bromophenyl)sulfonyl-2-nitroethenyl]-3,5-bis(trifluoromethyl)aniline.
Chemical Property Profile of 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE
Property Insights of 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE
The XLogP value of 5.4481 indicates that 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE 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 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE. Following Lipinski's Rule of Five, 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE?
The CAS number of 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE is 1025617-12-2.
What is the molecular formula of 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE?
The molecular formula of 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE is C16H9BrF6N2O4S.
What is the molecular weight of 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE?
The molecular weight of 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE is 517.94 g/mol.
Where can I buy 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE?
You can request a quote for 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE?
Yes, KEHONG BIO provides custom synthesis services for 2-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-1-((4-BROMOPHENYL)SULFONYL)-1-NITROETHENE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.