2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide
TL;DR: 2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide (CAS 577694-40-7) is a chemical compound with molecular formula C20H23N5OS and molecular weight 381.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-ethyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide
Also Known As: 2-{[4-ethyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide, 2-((4-Ethyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl)thio)-N-mesitylacetamide, 2-((4-ETHYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)-N-MESITYLACETAMIDE, 2-(4-ethyl-5-(2-pyridyl)(1,2,4-triazol-3-ylthio))-N-(2,4,6-trimethylphenyl)ace tamide, 2-[(4-ethyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide
| Molecular Formula | C20H23N5OS |
|---|---|
| Molecular Weight | 381.16 g/mol |
| LogP | 4.01606 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 381.16232 |
| Heavy Atoms | 27 |
| Complexity | 929.256 |
Chemical Identifiers
| CAS Number | 577694-40-7 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2C)C)C)C3=CC=CC=N3 |
Product Overview
2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide (CAS 577694-40-7), with molecular formula C20H23N5OS and molecular weight 381.16 g/mol. IUPAC: 2-[(4-ethyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide.
Chemical Property Profile of 2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide
Property Insights of 2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide
The XLogP value of 4.01606 indicates that 2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide. Following Lipinski's Rule of Five, 2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide 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-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide?
The CAS number of 2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide is 577694-40-7.
What is the molecular formula of 2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide?
The molecular formula of 2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide is C20H23N5OS.
What is the molecular weight of 2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide?
The molecular weight of 2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide is 381.16 g/mol.
Where can I buy 2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide?
You can request a quote for 2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-Ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-mesitylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.