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1-BENZYL-2-(METHYLSULFANYL)-1H-IMIDAZOLE-5-CARBOXYLIC ACID is a chemical compound with the molecular formula C15H14N2O2S. It is an imidazole derivative featuring a carboxylic acid group, a benzyl group, and a methylsulfanyl group. 1-BENZYL-2-(METHYLSULFANYL)-1H-IMIDAZOLE-5-CARBOXYLIC ACID possesses potential biological activities and is significant for its structural and pharmacological properties. It may be utilized in pharmaceutical research as a starting material for the synthesis of innovative drugs and could have potential therapeutic applications. Due to its potential reactivity and toxicity, it is crucial to handle and use this chemical compound with appropriate safety measures.

403479-30-1

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403479-30-1 Usage

Uses

Used in Pharmaceutical Research:
1-BENZYL-2-(METHYLSULFANYL)-1H-IMIDAZOLE-5-CARBOXYLIC ACID is used as a starting material for the synthesis of novel drugs in pharmaceutical research. Its unique structural and pharmacological properties make it a promising candidate for the development of new therapeutic agents.
Used in Drug Discovery:
In the drug discovery process, 1-BENZYL-2-(METHYLSULFANYL)-1H-IMIDAZOLE-5-CARBOXYLIC ACID is employed as a potential lead compound for the identification and optimization of new therapeutic agents. Its imidazole core and functional groups may contribute to its biological activity and interactions with target proteins or enzymes.
Used in Medicinal Chemistry:
1-BENZYL-2-(METHYLSULFANYL)-1H-IMIDAZOLE-5-CARBOXYLIC ACID is utilized in medicinal chemistry for the design and synthesis of new chemical entities with potential therapeutic applications. Its structural features can be modified to explore various chemical space and optimize the pharmacokinetic and pharmacodynamic properties of the resulting compounds.
Used in Chemical Synthesis:
In the field of chemical synthesis, 1-BENZYL-2-(METHYLSULFANYL)-1H-IMIDAZOLE-5-CARBOXYLIC ACID is used as a versatile building block for the preparation of various imidazole-based compounds. Its carboxylic acid and methylsulfanyl groups can be exploited for further functionalization and the formation of diverse chemical libraries.
Used in Safety and Toxicity Studies:
1-BENZYL-2-(METHYLSULFANYL)-1H-IMIDAZOLE-5-CARBOXYLIC ACID is employed in safety and toxicity studies to evaluate its potential reactivity and toxicity. Understanding its safety profile is essential for its proper handling and use in research and development settings.
Used in Quality Control and Analytical Chemistry:
In quality control and analytical chemistry, 1-BENZYL-2-(METHYLSULFANYL)-1H-IMIDAZOLE-5-CARBOXYLIC ACID is used as a reference compound for the development and validation of analytical methods. Its unique chemical properties can be leveraged for the accurate quantification and characterization of related compounds in various matrices.

Check Digit Verification of cas no

The CAS Registry Mumber 403479-30-1 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 4,0,3,4,7 and 9 respectively; the second part has 2 digits, 3 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 403479-30:
(8*4)+(7*0)+(6*3)+(5*4)+(4*7)+(3*9)+(2*3)+(1*0)=131
131 % 10 = 1
So 403479-30-1 is a valid CAS Registry Number.
InChI:InChI=1/C12H12N2O2S/c1-17-12-13-7-10(11(15)16)14(12)8-9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H,15,16)

403479-30-1SDS

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 3-benzyl-2-methylsulfanylimidazole-4-carboxylic acid

1.2 Other means of identification

Product number -
Other names 1-Benzyl-2-(methylthio)-1H-imidazole-5-carboxylic acid

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:403479-30-1 SDS

403479-30-1Relevant articles and documents

Synthesis of Novel N-Substituted Imidazolecarboxylic Acid Hydrazides as Monoamine Oxidase Inhibitors

Hadizadeh, Farzin,Ghodsi, Razieh

, p. 237 - 240 (2007/10/03)

Novel 2-alkylsulfanyl-1-benzyl-5-imidazolecarboxylic acid hydrazides (15a,b) were synthesized as analogues of isocarboxazide, which is a known nonselective irreversible monoamine oxidase inhibitor and tested for monoamine oxidase A and B inhibitory activity. Neither of the compounds showed any inhibition of MAO B activity up to a high concentration of 100 μM. An MAO A activity was only slowly inhibited at this high concentration after prolonged incubation with either compound. This suggests any observed inhibition is not very specific.

Syntheses of substituted 2-(2-alkylthio-1-benzyl-5-imidazolyl)-1,3,4-oxadiazoles

Hadizadeh,Tafti

, p. 841 - 844 (2007/10/03)

Starting from the readily available benzylamine hydrochloride a series of 2-(2-alkylthio-1-benzyl-5imidazolyl)-1,3,4-oxadiazoles were prepared.

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