2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide
TL;DR: 2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide (CAS 333331-30-9) is a chemical compound with molecular formula C18H19N5OS and molecular weight 353.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylphenyl)acetamide
Also Known As: BAS 02241101, 2-{[4-ethyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide, 2-((4-Ethyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(m-tolyl)acetamide, 2-((4-ET-5-(3-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)-N-(3-METHYLPHENYL)ACETAMIDE, 2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylphenyl)acetamide
| Molecular Formula | C18H19N5OS |
|---|---|
| Molecular Weight | 353.13 g/mol |
| LogP | 3.39922 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.13104 |
| Heavy Atoms | 25 |
| Complexity | 862.9128 |
Chemical Identifiers
| CAS Number | 333331-30-9 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C)C3=CN=CC=C3 |
Product Overview
2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide (CAS 333331-30-9), with molecular formula C18H19N5OS and molecular weight 353.13 g/mol. IUPAC: 2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methylphenyl)acetamide.
Chemical Property Profile of 2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide
Property Insights of 2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide
The XLogP value of 3.39922 indicates that 2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide 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-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide. Following Lipinski's Rule of Five, 2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide 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-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide?
The CAS number of 2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide is 333331-30-9.
What is the molecular formula of 2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide?
The molecular formula of 2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide is C18H19N5OS.
What is the molecular weight of 2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide?
The molecular weight of 2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide is 353.13 g/mol.
Where can I buy 2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide?
You can request a quote for 2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-ET-5-(3-Pyridinyl)-4H-1,2,4-triazol-3-YL)thio)-N-(3-methylphenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.