![2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide structure](/static/products/489/489463-51-6.png)
2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide
TL;DR: 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide (CAS 489463-51-6) is a chemical compound with molecular formula C16H17FN4OS and molecular weight 332.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,2-dicyano-1-(3-fluoroanilino)ethenyl]sulfanyl-N,N-diethylacetamide
Also Known As: 2-((2,2-dicyano-1-((3-fluorophenyl)amino)vinyl)thio)-N,N-diethylacetamide, 2-[2,2-dicyano-1-(3-fluoroanilino)ethenyl]sulfanyl-N,N-diethylacetamide, 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide, 2-[2,2-Dicyano-1-(3-fluoro-phenylamino)-vinylsulfanyl]-N,N-diethyl-acetamide
| Molecular Formula | C16H17FN4OS |
|---|---|
| Molecular Weight | 332.11 g/mol |
| LogP | 3.09796 |
| Topological Polar Surface Area | 79.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 332.11072 |
| Heavy Atoms | 23 |
| Complexity | 655.3932 |
Chemical Identifiers
| CAS Number | 489463-51-6 |
|---|---|
| SMILES | CCN(CC)C(=O)CSC(=C(C#N)C#N)NC1=CC(=CC=C1)F |
Product Overview
2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide (CAS 489463-51-6), with molecular formula C16H17FN4OS and molecular weight 332.11 g/mol. IUPAC: 2-[2,2-dicyano-1-(3-fluoroanilino)ethenyl]sulfanyl-N,N-diethylacetamide.
Chemical Property Profile of 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide
Property Insights of 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide
The XLogP value of 3.09796 indicates that 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide. Following Lipinski's Rule of Five, 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide 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-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide?
The CAS number of 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide is 489463-51-6.
What is the molecular formula of 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide?
The molecular formula of 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide is C16H17FN4OS.
What is the molecular weight of 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide?
The molecular weight of 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide is 332.11 g/mol.
Where can I buy 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide?
You can request a quote for 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-({2,2-dicyano-1-[(3-fluorophenyl)amino]ethenyl}sulfanyl)-N,N-diethylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.