(E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide
TL;DR: (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide (CAS 840518-57-2) is a chemical compound with molecular formula C16H20N6O4S and molecular weight 392.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-ethoxy-4-[(E)-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]hydrazinylidene]methyl]phenoxy]acetamide
Also Known As: (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide, 2-(2-Ethoxy-4-{[2-(4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetyl]-hydrazonomethyl}-phenoxy)-acetamide, 2-[2-ethoxy-4-[(E)-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]hydrazinylidene]methyl]phenoxy]acetamide, 2-{2-ethoxy-4-[(E)-(2-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazinylidene)methyl]phenoxy}acetamide
| Molecular Formula | C16H20N6O4S |
|---|---|
| Molecular Weight | 392.13 g/mol |
| LogP | 0.3203 |
| Topological Polar Surface Area | 133.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 392.12668 |
| Heavy Atoms | 27 |
| Complexity | 822.9919 |
Chemical Identifiers
| CAS Number | 840518-57-2 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)/C=N/NC(=O)CSC2=NN=CN2C)OCC(=O)N |
Product Overview
(E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide (CAS 840518-57-2), with molecular formula C16H20N6O4S and molecular weight 392.13 g/mol. IUPAC: 2-[2-ethoxy-4-[(E)-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]hydrazinylidene]methyl]phenoxy]acetamide.
Chemical Property Profile of (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide
Property Insights of (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide
The XLogP value of 0.3203 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide. The TPSA of 133.72 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide. Following Lipinski's Rule of Five, (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide has 2 hydrogen bond donor(s) and 8 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 (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide?
The CAS number of (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide is 840518-57-2.
What is the molecular formula of (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide?
The molecular formula of (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide is C16H20N6O4S.
What is the molecular weight of (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide?
The molecular weight of (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide is 392.13 g/mol.
Where can I buy (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide?
You can request a quote for (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(2-ethoxy-4-((2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetyl)hydrazono)methyl)phenoxy)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.