2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide
TL;DR: 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide (CAS 617697-44-6) is a chemical compound with molecular formula C21H13ClF3N3OS and molecular weight 447.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[6-(4-chlorophenyl)-3-cyano-4-(trifluoromethyl)-2-pyridinyl]sulfanyl]-N-phenylacetamide
Also Known As: 2-{[6-(4-chlorophenyl)-3-cyano-4-(trifluoromethyl)-2-pyridinyl]thio}-N-phenylacetamide, 2-((6-(4-CL-PH)-3-CYANO-4-(TRIFLUOROMETHYL)-2-PYRIDINYL)THIO)-N-PHENYLACETAMIDE, 2-[6-(4-chlorophenyl)-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-phenylacetamide, 2-{[6-(4-chlorophenyl)-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-phenylacetamide, 2-[6-(4-chlorophenyl)-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-phenyl-acetamide
| Molecular Formula | C21H13ClF3N3OS |
|---|---|
| Molecular Weight | 447.04 g/mol |
| LogP | 6.02328 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 447.042 |
| Heavy Atoms | 30 |
| Complexity | 1097.4648 |
Chemical Identifiers
| CAS Number | 617697-44-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)Cl)C(F)(F)F)C#N |
Product Overview
2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide (CAS 617697-44-6), with molecular formula C21H13ClF3N3OS and molecular weight 447.04 g/mol. IUPAC: 2-[[6-(4-chlorophenyl)-3-cyano-4-(trifluoromethyl)-2-pyridinyl]sulfanyl]-N-phenylacetamide.
Chemical Property Profile of 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide
Property Insights of 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide
The XLogP value of 6.02328 indicates that 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide. Following Lipinski's Rule of Five, 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide?
The CAS number of 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide is 617697-44-6.
What is the molecular formula of 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide?
The molecular formula of 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide is C21H13ClF3N3OS.
What is the molecular weight of 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide?
The molecular weight of 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide is 447.04 g/mol.
Where can I buy 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide?
You can request a quote for 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((6-(4-CL-PH)-3-Cyano-4-(trifluoromethyl)-2-pyridinyl)thio)-N-phenylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.