Description

5,5-Diallyl-1-(n-Benzylcarbamoylmethyl)-2,4,6(1H,3H,5H)-Pyrimidinetrione is a specialized heterocyclic organic compound with a complex molecular architecture. This chemical is valued as a key synthetic intermediate or precursor in advanced pharmaceutical and agrochemical research, enabling the construction of novel active molecules. It is primarily sought by R&D chemists and process development scientists in the fine chemical, pharmaceutical, and life science industries for applications in medicinal chemistry and custom synthesis.

Application

• Pharmaceutical Intermediate: Serves as a crucial building block in the synthesis of novel drug candidates, particularly those targeting central nervous system (CNS) disorders or possessing specific receptor-binding profiles.
• Agrochemical Research: Used in the development of new active ingredients for crop protection, leveraging its pyrimidinetrione core structure.
• Medicinal Chemistry: Employed in structure-activity relationship (SAR) studies and lead optimization processes to develop compounds with improved efficacy and pharmacokinetic properties.
• Custom Synthesis & Contract Manufacturing: Supplied to CDMOs (Contract Development and Manufacturing Organizations) for the production of bespoke compounds for client research programs.
• Biochemical Tool Compound: Potential use as a probe or inhibitor in biochemical assays to study specific enzymatic pathways or biological mechanisms.
• Academic Research: Utilized in university and institutional laboratories for fundamental studies in organic synthesis and heterocyclic chemistry.

Basic Information

Product Name	5,5-Diallyl-1-(n-Benzylcarbamoylmethyl)-2,4,6(1H,3H,5H)-Pyrimidinetrione
CAS No.	66941-95-5
Molecular Formula	C20H21N3O4
Molecular Weight	367.40 g/mol
Synonyms	1-(Benzylcarbamoylmethyl)-5,5-diallylbarbituric acid; 5,5-Diallyl-1-[(phenylmethyl)carbamoyl]methyl]-2,4,6-pyrimidinetrione; 5,5-Diallyl-1-(benzylaminocarbonylmethyl)barbituric acid; N-Benzyl-N-(5,5-diallyl-2,4,6-trioxo-1,3-diazinan-1-yl)acetamide; Barbituric acid, 5,5-diallyl-1-[(phenylmethyl)carbamoyl]methyl]-; 66941-95-5; Diallyl benzylcarbamoylmethyl barbiturate
EINECS	Contact for details

Quality Control

Our 5,5-Diallyl-1-(n-Benzylcarbamoylmethyl)-2,4,6(1H,3H,5H)-Pyrimidinetrione is manufactured under strict quality management systems. Each batch undergoes rigorous analytical testing, including HPLC, NMR, and mass spectrometry, to ensure identity, purity, and consistency. We provide comprehensive Certificates of Analysis (COA) with each shipment, detailing all critical specifications. Our quality commitment ensures material suitable for demanding research and development applications.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at controlled room temperature (15-25°C). Keep away from heat, sparks, and open flame. For long-term storage, consider holding under an inert atmosphere to maintain stability.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Loss on Drying	≤ 0.5%
Residue on Ignition	≤ 0.1%
Heavy Metals	≤ 20 ppm

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