(Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate
TL;DR: (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate (CAS 524032-93-7) is a chemical compound with molecular formula C26H25N5O2S and molecular weight 471.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-2-(phenylhydrazinylidene)-2-[[4-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate
Also Known As: (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate, ethyl (2Z)-(2-phenylhydrazinylidene){[4-phenyl-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanoate, ethyl (2Z)-2-[(5-phenethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-(phenylhydrazinylidene)acetate
| Molecular Formula | C26H25N5O2S |
|---|---|
| Molecular Weight | 471.17 g/mol |
| LogP | 5.1333 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 471.17288 |
| Heavy Atoms | 34 |
| Complexity | 1228.0626 |
Chemical Identifiers
| CAS Number | 524032-93-7 |
|---|---|
| SMILES | CCOC(=O)/C(=N/NC1=CC=CC=C1)/SC2=NN=C(N2C3=CC=CC=C3)CCC4=CC=CC=C4 |
Product Overview
(Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate (CAS 524032-93-7), with molecular formula C26H25N5O2S and molecular weight 471.17 g/mol. IUPAC: ethyl (2Z)-2-(phenylhydrazinylidene)-2-[[4-phenyl-5-(2-phenylethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate.
Chemical Property Profile of (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate
Property Insights of (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate
The XLogP value of 5.1333 indicates that (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate. Following Lipinski's Rule of Five, (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate?
The CAS number of (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate is 524032-93-7.
What is the molecular formula of (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate?
The molecular formula of (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate is C26H25N5O2S.
What is the molecular weight of (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate?
The molecular weight of (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate is 471.17 g/mol.
Where can I buy (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate?
You can request a quote for (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-ethyl 2-((5-phenethyl-4-phenyl-4H-1,2,4-triazol-3-yl)thio)-2-(2-phenylhydrazono)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.