Description

Ethyl 4-({[(5-{[(4,6-Dimethyl-2-Pyrimidinyl)Sulfanyl]Methyl}-4-Phenyl-4H-1,2,4-Triazol-3-Yl)Sulfanyl]Acetyl}Amino)Benzoate is a high-purity, advanced pharmaceutical intermediate featuring a complex heterocyclic structure. This compound is critical for the research and development of novel therapeutic agents, particularly in the fields of oncology and anti-infectives. It is primarily utilized by pharmaceutical R&D laboratories, fine chemical manufacturers, and academic research institutions engaged in medicinal chemistry and drug discovery programs.

Application

• Pharmaceutical Intermediate: Serves as a key building block in the synthesis of potential drug candidates targeting specific enzymes or receptors.
• Medicinal Chemistry Research: Used in structure-activity relationship (SAR) studies to optimize the efficacy and pharmacokinetic properties of new chemical entities.
• Biochemical Probe Development: Acts as a precursor for creating labeled compounds used in biological assays and mechanism-of-action studies.
• Fine Chemical Synthesis: Employed in multi-step organic syntheses requiring high-purity, specialized heterocyclic components.
• Contract Research & Manufacturing (CRAM): Supplied to organizations providing custom synthesis and process development services for the pharmaceutical industry.

Basic Information

Product Name	Ethyl 4-({[(5-{[(4,6-Dimethyl-2-Pyrimidinyl)Sulfanyl]Methyl}-4-Phenyl-4H-1,2,4-Triazol-3-Yl)Sulfanyl]Acetyl}Amino)Benzoate
CAS No.	335397-87-0
Molecular Formula	C26H26N6O3S2
Molecular Weight	526.65 g/mol
Synonyms	Ethyl 4-[[2-[[5-[(4,6-Dimethyl-2-pyrimidinyl)thio]methyl]-4-phenyl-4H-1,2,4-triazol-3-yl]thio]acetylamino]benzoate; Benzoic acid, 4-[[2-[[5-[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-4-phenyl-4H-1,2,4-triazol-3-yl]thio]acetyl]amino]-, ethyl ester; 335397-87-0; SCHEMBL23306277; AKOS040759623; ZINC000253899996; A1B1_077277 (ChemDiv)
EINECS	Contact for details

Quality Control

Our Ethyl 4-({[(5-{[(4,6-Dimethyl-2-Pyrimidinyl)Sulfanyl]Methyl}-4-Phenyl-4H-1,2,4-Triazol-3-Yl)Sulfanyl]Acetyl}Amino)Benzoate is manufactured under strict quality management systems. Each batch undergoes rigorous analytical testing, including HPLC for purity and identity confirmation via NMR and mass spectrometry, to ensure it meets the high standards required for pharmaceutical research. Certificates of Analysis (COA) detailing all specifications are available upon request.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, well-ventilated area at a controlled room temperature (typically 15-25°C). Keep the container tightly sealed to protect from moisture.

Specification

Item	Specification
Appearance	White to off-white powder
Identification (IR)	Conforms to structure
Identification (HPLC)	Retention time matches reference standard
Purity (HPLC)	≥ 97.0%
Related Substances (HPLC)	Any single impurity ≤ 1.0%
Total Impurities	≤ 3.0%
Residual Solvents (GC)	Complies with ICH Q3C guidelines
Water Content (KF)	≤ 0.5%

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.