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(1E)-1-(4-bromophenyl)ethanone thiosemicarbazone is a chemical compound derived from thiosemicarbazide and 1-(4-bromophenyl)ethanone. It is a yellow crystalline solid with the molecular formula C9H10BrN3S and a molar mass of 259.16 g/mol. (1E)-1-(4-bromophenyl)ethanone thiosemicarbazone has been studied for its potential biological and pharmacological properties, including antimicrobial, antifungal, and anticancer activities. Additionally, it is known to form complexes with various metal ions and has been investigated for its potential use in analytical chemistry and catalysis. (1E)-1-(4-bromophenyl)ethanone thiosemicarbazone's structural and functional properties make it a subject of interest for further research in the fields of medicinal chemistry and materials science.

16546-06-8

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16546-06-8 Usage

Uses

Used in Pharmaceutical Industry:
(1E)-1-(4-bromophenyl)ethanone thiosemicarbazone is used as a pharmaceutical candidate for its antimicrobial, antifungal, and anticancer activities. Its potential biological and pharmacological properties make it a promising compound for the development of new drugs and therapies.
Used in Analytical Chemistry:
(1E)-1-(4-bromophenyl)ethanone thiosemicarbazone is used as a reagent in analytical chemistry for the formation of complexes with various metal ions. This property allows for the detection, analysis, and quantification of metal ions in different samples.
Used in Materials Science:
(1E)-1-(4-bromophenyl)ethanone thiosemicarbazone is used in materials science for its potential applications in the development of new materials with unique properties. Its structural and functional characteristics make it a valuable compound for further research and development in this field.
Used in Catalysis:
(1E)-1-(4-bromophenyl)ethanone thiosemicarbazone is used as a catalyst in various chemical reactions. Its ability to form complexes with metal ions can enhance the efficiency and selectivity of catalytic processes, making it a useful compound in the field of catalysis.

Check Digit Verification of cas no

The CAS Registry Mumber 16546-06-8 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 1,6,5,4 and 6 respectively; the second part has 2 digits, 0 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 16546-06:
(7*1)+(6*6)+(5*5)+(4*4)+(3*6)+(2*0)+(1*6)=108
108 % 10 = 8
So 16546-06-8 is a valid CAS Registry Number.

16546-06-8SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name [(Z)-1-(4-bromophenyl)ethylideneamino]thiourea

1.2 Other means of identification

Product number -
Other names p-bromoacetophenone oxime

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:16546-06-8 SDS

16546-06-8Relevant academic research and scientific papers

Synthesis, Characterization, and Anticancer Screening of Some New Bithiazole Derivatives

Abbas, E. M. H.,Awad, H. M.,Farghaly, T. A.,Latif, N. A. Abdel

, p. 1096 - 1107 (2020)

Abstract: Twenty new bithiazole derivatives were synthesized by condensation of2-{2-[(1-arylethylidene)hydrazinylidene]thiazolidin-4-ylidene}hydrazine-1-carbothioamideswith halo ketones, halo esters, and α-keto hydrazonoyl halides. The structuresof all pr

Acetic acid mediated regioselective synthesis of 2,4,5-trisubstituted thiazoles by a domino multicomponent reaction

Saroha, Mohit,Khurana, Jitender M.

, p. 8644 - 8650 (2019)

Acetic acid mediated regioselective synthesis of novel 2,4,5-trisubstituted thiazole derivatives has been reported by a domino reaction of thiosemicarbazide and aldehydes/ketones/isatin, to generate thiosemicarbazones (in situ) followed by addition of arylglyoxal and active methylene/activated C-H acids/pyrazole/indole in ethanol at 80 °C. The products are obtained in high yields by a simple work up. Metal free, short reaction time and high yields are some merits of this methodology.

Microwave-assisted Vilsmeier-Haack synthesis of Pyrazole-4-carbaldehydes

Kumari, Poonam,Sood, Sumit,Kumar, Anil,Singh, Karan

, p. 796 - 804 (2019/11/28)

The synthesis of 4-formylpyrazoles using Vilsmeier-Haack reagent is a common protocol in pyrazole chemistry. An efficient microwave-assisted synthesis of 4-formylpyrazoles by employing Vilsmeier-Haack reagent (OPC-VH) derived from phthaloyl dichloride/dimethylformamide has been described. This method offers the advantages of operational simplicity, avoiding the use of POCl3 as toxic reagents and reuse of the by-product in the preparation of phthaloyl dichloride.

Microwave-assisted synthesis and biological evaluation of new thiazolylhydrazone derivatives as tyrosinase inhibitors and antioxidants

Fu, Xi,Liu, Jinbing,Yan, Yangting,Zhang, Yu

, (2020/02/04)

In this work, we have synthesized a series of 2-thiazolylhydrazone derivatives (1–27) and investigated their biological activities as tyrosinase inhibitors and antioxidants. Some compounds showed potent tyrosinase inhibitory activities and 4-(2-(2-(1-(4-Aminophenyl)ethylidene)-hydrazinyl)thiazol-4-yl) phenol (26) showed more potent inhibitory effect than the standard tyrosinase inhibitor kojic acid (IC50: 9.8 μM vs. 23.6 μM). Compounds 2, 14, and 26 exhibited high antioxidant activities in 2,2-diphenyl-1-picrylhydrazyl (DPPH) and 2,2′-azinobis (3-ethylbenzothiazoline-6-sulfonic acid) (ABTS) assays. The structure–activity relationship (SAR) indicated that the substitutions of bromine, hydroxyl group, and amino groups cause great effect to the inhibition effect against tyrosinase. The mechanism and kinetic studies demonstrated that the inhibitory effect of compound 26 on the tyrosinase by acting as the reversible and uncompetitive inhibitor. Docking studies suggests that compound 26 interacts strongly with mushroom tyrosinase via hydrogen bonding.

Microwave-assisted synthesis and biological evaluation of pyrazole-4-carbonitriles as antimicrobial agents

Kumar, Anil,Kumari, Poonam,Singh, Karan,Sood, Sumit,Yadav, Ajar Nath

, (2020/05/25)

An efficient microwave-assisted method of synthesis of pyrazole-4-carbonitriles has been developed. Condensation of pyrazole-4-carbaldehydes with hydroxylamine hydrochloride followed by reaction of the resulting oximes with the Vilsmeier-Haack reagent pre-formed from phthaloyl dichloride and dimethylformamide under microwave irradiation afforded the corresponding pyrazole-4-carbonitriles in 73percent to 91percent yield. The operational simplicity, avoidance of toxic reagents such as POCl3, shorter reaction time, higher yield compared to the classical version, easy work up, and the use of the by-product in the regeneration of phthaloyl dichloride are the advantages of this methodology. All the target compounds were tested for antimicrobial activity against Gram-positive bacteria Bacillus cereus and Staphylococcus aureus; Gram-negative bacteria Escherichia coli and Yersinia enterocolitica, and the fungal species Candida albicans.

Design, synthesis and molecular docking studies of some thiazole clubbed heterocyclic compounds as possible anti-infective agents

Sharma, Prabodh Chander,Saini, Anil,Bansal, Kushal Kumar,Sharma, Archana,Gupta, Girish Kumar

, p. 716 - 726 (2018/07/13)

The present work describes synthesis of a series of 5-((1-(4-(4-chlorophenyl)thiazol-2-yl)-3- aryl-1H-pyrazol-4-yl)methylene)-2-(arylimino)thiazolidin-4-one derivatives and their molecular docking and biological evaluation as possible antimalarial, anthelmintic and antimicrobial agents. The synthesis of compounds has been accomplished by adopting suitable synthetic methods. Structures of newly synthesized compounds were characterized and authenticated by spectral methods such as IR, 1H-NMR and mass spectra. Synthesized compounds were screened for their in vitro antimicrobial activity against selected bacterial strains and fungal strains viz. B. subtilis, S. aureus, E. coli, P. fluorescens, C. albicans, C. glabrata and antimalarial studies against P. falciparum. Titled compounds were also tested against Pheretima posthuma (earthworm) for their anthelmintic activity. Molecular docking was done to study the binding modes of the potent compounds against Escherichia coli (PDB ID: 1AB4) and Candida P450DM (PDB ID: 1EA1) enzymes. The results revealed that all the compounds exhibited moderate to significant antimicrobial activities. Antimalarial activity screening revealed that one compound 8i showed significant antimalarial activity with of IC50; 0.59 μg/mL as compared to standard drugs chloroquine (IC50= 0.020 μg/mL) and quinine (IC50; 0.268 μg/mL). The most active compound exhibited the mean paralysis time of 19.2 ± 0.9 min and mean death time of 31.7 ± 2.5 min. It can be concluded that some of the synthesized compounds have remarkable antiinfective, antimalarial and anthelmintic activity and are suitable candidates for further scientific exploration.

Novel thiazole clubbed triazole derivatives as antimicrobial, antimalarial, and cytotoxic agents

Bansal, Kushal K.,Sharma, Diksha,Sharma, Archana,Rajak, Harish,Sharma, Prabodh C.

, p. 305 - 312 (2018/09/14)

Thiazole is one of the most potential heterocyclic moieties in bioorganic chemistry and is major tool in drug design and discovery. The present work describes the synthesis of a series of N-{(1-(4-(4bromophenyl) thiazol-2-yl)-3-substitutedphenyl-1H-pyrazo

Structure-activity relationship study of thiosemicarbazones on an African trypanosome: Trypanosoma brucei brucei

Fatondji, Houssou Raymond,Kpoviessi, Salome,Gbaguidi, Fernand,Bero, Joanne,Hannaert, Veronique,Quetin-Leclercq, Joelle,Poupaert, Jacques,Moudachirou, Mansourou,Accrombessi, Georges Coffi

, p. 2151 - 2162 (2013/07/26)

To explore the structure-activity relationships of thiosemicarbazones on African trypanosome: Trypanosoma brucei brucei, a series of thirty-five thiosemicarbazones (1-35) have been synthesized and characterized by their 1H NMR, 13C NMR, and FT-IR spectra. All compounds were tested for trypanocidal activity using the method "Lilit alamar blue". The comparison of trypanocidal power of thiosemicarbazones was performed considering their structures. This study that was done using acetophenone thiosemicarbazone (1) as basic model, showed that: (a) the presence of lipophilic substituents in para position on benzene ring, (b) substitution of benzene ring and (c) substitution of hydrogen of thioamide function by a phenyl, strongly influence trypanocidal activity. The various modifications to basic structure (1) allowed the synthesis of 1-(4-chlorophenyl) ethylidene-4-phenyl- thiosemicarbazide (34). With a trypanocidal activity of 3.97 μM, this compound is the most active of the series.

A new type of synthesis of 1,2,3- Thiadiazole and 1,2,3-diazaphosphole derivatives via-hurd-mori cyclization

Hosny, Mona A.,El-Sayed, Taghreed H.,El-Sawi, Emtithal A.

experimental part, p. 1276 - 1287 (2012/06/01)

We present a short and efficient synthesis of the title compounds starting with cheap and readily available camphor and derivatives of acetophenone. The optimized sequence allows the large-scale preparation of this new type of synthesis in a few steps. Ne

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