2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile
TL;DR: 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile (CAS 882255-74-5) is a chemical compound with molecular formula C15H10ClFN2O2S and molecular weight 336.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)sulfonyl-3-(3-fluoroanilino)prop-2-enenitrile
Also Known As: 2-((4-CHLOROPHENYL)SULFONYL)-3-((3-FLUOROPHENYL)AMINO)PROP-2-ENENITRILE, 2-(4-chlorophenyl)sulfonyl-3-(3-fluoroanilino)prop-2-enenitrile, (2Z)-2-(4-chlorobenzenesulfonyl)-3-[(3-fluorophenyl)amino]prop-2-enenitrile, C15H10ClFN2O2S
| Molecular Formula | C15H10ClFN2O2S |
|---|---|
| Molecular Weight | 336.01 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 78.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.01355 |
| Heavy Atoms | 22 |
| Complexity | 556.0 |
Chemical Identifiers
| CAS Number | 882255-74-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)NC=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl |
| InChIKey | HVGQCKNAGZFFSM-UHFFFAOYSA-N |
Product Overview
2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile (CAS 882255-74-5), with molecular formula C15H10ClFN2O2S and molecular weight 336.01 g/mol. IUPAC: 2-(4-chlorophenyl)sulfonyl-3-(3-fluoroanilino)prop-2-enenitrile.
Chemical Property Profile of 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile
Property Insights of 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile
The XLogP value of 4.0 indicates that 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile. Following Lipinski's Rule of Five, 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile 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 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile?
The CAS number of 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile is 882255-74-5.
What is the molecular formula of 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile?
The molecular formula of 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile is C15H10ClFN2O2S.
What is the molecular weight of 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile?
The molecular weight of 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile is 336.01 g/mol.
Where can I buy 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile?
You can request a quote for 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-Chlorophenyl)sulfonyl)-3-((3-fluorophenyl)amino)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.