49656-91-9

Basic information

• Product Name: (4,5-DIPHENYL-4H-[1,2,4]TRIAZOL-3-YLSULFANYL)-ACETIC ACID HYDRAZIDE
• Synonyms: Aceticacid, 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio]-, hydrazide
• CAS NO: 49656-91-9
• Molecular Formula: C₁₆H₁₅N₅OS
• Molecular Weight: 325.39
• Mol File: 49656-91-9.mol
• Article Data: 6

Chemical Properties

• Melting Point: 217-218 °C(Solv: ethanol (64-17-5))
• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Appearance: /
• Density: 1.36g/cm³
• Refractive Index: 1.702
• PKA: 11.70±0.37(Predicted)
• CAS DataBase Reference: (4,5-DIPHENYL-4H-[1,2,4]TRIAZOL-3-YLSULFANYL)-ACETIC ACID HYDRAZIDE(CAS DataBase Reference)
• NIST Chemistry Reference: (4,5-DIPHENYL-4H-[1,2,4]TRIAZOL-3-YLSULFANYL)-ACETIC ACID HYDRAZIDE(49656-91-9)
• EPA Substance Registry System: (4,5-DIPHENYL-4H-[1,2,4]TRIAZOL-3-YLSULFANYL)-ACETIC ACID HYDRAZIDE(49656-91-9)

Safety Data

• Hazardous Substances Data: 49656-91-9(Hazardous Substances Data)

Usage

General Description

(4,5-Diphenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid hydrazide is a chemical compound with potential applications in various fields including pharmaceuticals and agriculture. It is a hydrazide derivative of acetic acid and contains a triazole ring with a phenyl group attached to it. The compound has attracted interest due to its potential as a bioactive molecule with antimicrobial and antifungal properties. It also has the potential to act as a chelating agent or as a precursor in the synthesis of organic compounds. Its unique structure and properties make it a target for further research and potential applications in various industries.

InChI:InChI=1/C16H15N5OS/c17-18-14(22)11-23-16-20-19-15(12-7-3-1-4-8-12)21(16)13-9-5-2-6-10-13/h1-10H,11,17H2,(H,18,22)

Upstream product

• 91759-70-5 ethyl 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetate 
• 103-72-0 phenyl isothiocyanate 
• 613-94-5 benzoic acid hydrazide 
• 6596-82-3 4,5-diphenyl-4H-1,2,4-triazole-3-thiol 
• 6596-82-3 4,5-diphenyl-2,4-dihydro-[1,2,4]triazole-3-thione 
• 1768-59-8 1,4-diphenylthiosemicarbazide 
• 13153-01-0 1-benzoyl-4-phenyl-3-thiosemicarbazide 

Downstream Products

• 93300-42-6 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-methylphenyl)methylidene]acetohydrazide 
• 93300-45-9 (4,5-Diphenyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid [1-(4-chloro-phenyl)-meth-(Z)-ylidene]-hydrazide 
• 93300-43-7 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-methoxyphenyl)methylidene]acetohydrazide 
• 93300-41-5 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-hydroxyphenyl)methylidene]acetohydrazide 
• 58360-47-7 5-[(4,5-diphenyl-4H-1,2,4-triazol-3-ylthio)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol 
• 93300-36-8 5-(4,5-Diphenyl-4H-[1,2,4]triazol-3-ylsulfanylmethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol 
• 93300-37-9 5-(4,5-Diphenyl-4H-[1,2,4]triazol-3-ylsulfanylmethyl)-4-naphthalen-1-yl-4H-[1,2,4]triazole-3-thiol 
• 1415559-07-7 4-ethyl-5-{[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-4H-1,2,4-triazole-3(2H)-thione 
• 58360-48-8 4-allyl-5-{[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-4H-1,2,4-triazole-3(2H)-thione 
• 537016-49-2 4-cyclohexyl-5-{[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-4H-1,2,4-triazole-3(2H)-thione 
• 58360-47-7 4-phenyl-5-{[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-4H-1,2,4-triazole-3(2H)-thione 
• 449782-42-7 4-(4-bromophenyl)-5-{[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-4H-1,2,4-triazole-3(2H)-thione 
• 1400271-85-3 4-(4-chlorophenyl)-5-{[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-4H-1,2,4-triazole-3(2H)-thione 
• 537016-53-8 4-(4-methoxyphenyl)-5-{[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-4H-1,2,4-triazole-3(2H)-thione 

Relevant articles and documents

Alkylation of 1,2,4-triazole-3-thiols with haloalkanoic acid esters

Alkylation of 4,5-disubstituted 4H-1,2,4-triazole-3-thiols with methyl chloroformate and ethyl chloroacetate chemoselectively afforded the corresponding S-alkyl derivatives, whereas the alkylation of 5-benzyl-4-phenyl-4H-1,2,4-triazole-3-thiol with methyl 3-bromopropanoate gave an inseparable mixture of S- and N-alkylation products. Hydrazinolysis of S-(5-benzyl-4-phenyl-4H-1,2,4-triazol-3-yl) methyl carbonothioate involved anomalous cleavage with formation of the initial 4,5-disubstituted 1,2,4-triazole and methyl hydrazinecarboxylate.

Synthesis and Antimicrobial Evaluation of New Schiff Base Hydrazones Bearing 1,2,4-Triazole Moiety

This study presents the synthesis and spectral analysis of new Schiff base hydrazone derivatives. New compounds were prepared by the reaction of [(4-phenyl-5-substituted-4H-1,2,4-triazol-3-yl)sulfanyl] acetohydrazide with various aldehydes. The structures

Synthesis, in vitro cytotoxicity, and antibacterial studies of new asymmetric bis-1,2,4-triazoles

A series of asymmetric bis-1,2,4-triazoles (4a-l) were synthesized from respective 1,2,4-triazole-3-thiocarbohydrazides (2a, b) via base catalyzed dehydrative cyclization of thiosemicarbazide intermediates (3a-l). The synthesized compounds were characteri