2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide
TL;DR: 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide (CAS 445381-69-1) is a chemical compound with molecular formula C21H16FN5OS2 and molecular weight 437.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-amino-3,5-dicyano-4-thiophen-2-yl-2-pyridinyl)sulfanyl]-N-[2-(4-fluorophenyl)ethyl]acetamide
Also Known As: 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide, 2-(6-amino-3,5-dicyano-4-thiophen-2-yl-pyridin-2-yl)sulfanyl-N-[2-(4-fluorophenyl)ethyl]acetamide, 2-(6-amino-3,5-dicyano-4-thiophen-2-ylpyridin-2-yl)sulfanyl-N-[2-(4-fluorophenyl)ethyl]acetamide, 2-{[6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-[2-(4-fluorophenyl)ethyl]acetamide
| Molecular Formula | C21H16FN5OS2 |
|---|---|
| Molecular Weight | 437.08 g/mol |
| LogP | 3.72576 |
| Topological Polar Surface Area | 115.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 437.07803 |
| Heavy Atoms | 30 |
| Complexity | 1132.184 |
Chemical Identifiers
| CAS Number | 445381-69-1 |
|---|---|
| SMILES | C1=CSC(=C1)C2=C(C(=NC(=C2C#N)SCC(=O)NCCC3=CC=C(C=C3)F)N)C#N |
Product Overview
2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide (CAS 445381-69-1), with molecular formula C21H16FN5OS2 and molecular weight 437.08 g/mol. IUPAC: 2-[(6-amino-3,5-dicyano-4-thiophen-2-yl-2-pyridinyl)sulfanyl]-N-[2-(4-fluorophenyl)ethyl]acetamide.
Chemical Property Profile of 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide
Property Insights of 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide
The XLogP value of 3.72576 indicates that 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide. Following Lipinski's Rule of Five, 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide has 2 hydrogen bond donor(s) and 7 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-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide?
The CAS number of 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide is 445381-69-1.
What is the molecular formula of 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide?
The molecular formula of 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide is C21H16FN5OS2.
What is the molecular weight of 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide?
The molecular weight of 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide is 437.08 g/mol.
Where can I buy 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide?
You can request a quote for 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((6-amino-3,5-dicyano-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(4-fluorophenethyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.