Description

3-(2-{(E)-[1-(2,4-Dimethylphenyl)-4,6-Dioxo-2-Thioxotetrahydropyrimidin-5(2H)-Ylidene]Methyl}-1H-Pyrrol-1-Yl)Benzoic Acid is a sophisticated heterocyclic organic compound featuring a benzoic acid moiety linked to a complex tetrahydropyrimidine-thione core. This molecular architecture makes it a valuable advanced intermediate for research and development in pharmaceutical chemistry and materials science. It is primarily sought by R&D chemists and process development scientists in the pharmaceutical, agrochemical, and specialty chemical industries for synthesizing novel active compounds.

Application

• Pharmaceutical Intermediate: Key building block for the synthesis of novel drug candidates, particularly those targeting specific enzymatic pathways.
• Agrochemical Research: Used in the development of new herbicides, fungicides, or plant growth regulators due to its complex heterocyclic structure.
• Organic Electronic Materials: Serves as a precursor for creating specialized organic semiconductors or charge-transport materials.
• Chemical Biology Probes: Utilized in the design and synthesis of molecular probes for studying biological processes and target engagement.
• Coordination Chemistry: Potential ligand for metal complexes in catalysis or material science applications.
• Academic & Institutional Research: Employed in universities and research institutes for fundamental studies in synthetic methodology and heterocyclic chemistry.

Basic Information

Product Name	3-(2-{(E)-[1-(2,4-Dimethylphenyl)-4,6-Dioxo-2-Thioxotetrahydropyrimidin-5(2H)-Ylidene]Methyl}-1H-Pyrrol-1-Yl)Benzoic Acid
CAS No.	593272-77-6
Molecular Formula	C24H19N3O4S
Molecular Weight	445.49 g/mol
Synonyms	Benzoic acid, 3-[2-[(1E)-[1-(2,4-dimethylphenyl)-4,6-dioxo-2-thioxo-5-tetrahydropyrimidinylidene]methyl]-1H-pyrrol-1-yl]-; 3-(2-{(E)-[1-(2,4-Dimethylphenyl)-4,6-Dioxo-2-Thioxo-1,2,3,6-tetrahydropyrimidin-5-ylidene]methyl}-1H-pyrrol-1-yl)benzoic Acid; 593272-77-6; 3-[2-[(E)-[1-(2,4-Dimethylphenyl)-4,6-dioxo-2-sulfanylidene-3,4-dihydropyrimidin-5(2H,6H)-ylidene]methyl]-1H-pyrrol-1-yl]benzoic acid
EINECS	Contact for details

Quality Control

Every batch of this advanced intermediate is produced under strict quality management protocols. We employ advanced analytical techniques including HPLC, NMR, and MS to ensure identity, purity, and consistency. A comprehensive Certificate of Analysis (COA) detailing purity, assay, and impurity profiles is provided with each shipment to support your R&D and regulatory documentation needs.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at a controlled room temperature (typically 15-25°C). Keep away from incompatible materials. For long-term storage, consider inert atmosphere conditions to preserve stability.

Specification

Item	Specification
Appearance	Yellow to brown powder
Identification (IR)	Conforms to structure
Identification (HPLC)	Conforms to reference
Purity (HPLC)	≥ 95%
Water Content (KF)	≤ 1.0%
Residue on Ignition	≤ 0.5%

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