![4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline structure](/static/products/3214/321433-82-3.webp)
4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline
TL;DR: 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline (CAS 321433-82-3) is a chemical compound with molecular formula C14H11FN2O4S and molecular weight 322.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(benzenesulfonyl)-2-nitroethenyl]-4-fluoroaniline
Also Known As: 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline, N-[2-(benzenesulfonyl)-2-nitroethenyl]-4-fluoroaniline, 2-((4-FLUOROPHENYL)AMINO)-1-NITRO-1-(PHENYLSULFONYL)ETHENE, N-[2-(benzenesulfonyl)-2-nitro-vinyl]-4-fluoro-aniline
| Molecular Formula | C14H11FN2O4S |
|---|---|
| Molecular Weight | 322.04 g/mol |
| LogP | 2.7871 |
| Topological Polar Surface Area | 89.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.04236 |
| Heavy Atoms | 22 |
| Complexity | 802.4963 |
Chemical Identifiers
| CAS Number | 321433-82-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)C(=CNC2=CC=C(C=C2)F)[N+](=O)[O-] |
Product Overview
4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline (CAS 321433-82-3), with molecular formula C14H11FN2O4S and molecular weight 322.04 g/mol. IUPAC: N-[2-(benzenesulfonyl)-2-nitroethenyl]-4-fluoroaniline.
Chemical Property Profile of 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline
Property Insights of 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline
The XLogP value of 2.7871 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline. The TPSA of 89.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline. Following Lipinski's Rule of Five, 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline 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 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline?
The CAS number of 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline is 321433-82-3.
What is the molecular formula of 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline?
The molecular formula of 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline is C14H11FN2O4S.
What is the molecular weight of 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline?
The molecular weight of 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline is 322.04 g/mol.
Where can I buy 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline?
You can request a quote for 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-fluoro-N-[2-nitro-2-(phenylsulfonyl)vinyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.