Description

4-(2,4,6-Trifluorobenzyl)-1-([6-(Trifluoromethyl)Pyridin-3-Yl]Methyl)-1,4-Diazepan-5-One is a high-value, fluorinated diazepanone derivative, serving as a critical advanced intermediate in modern pharmaceutical synthesis. Its complex structure, featuring multiple fluorine atoms and a pyridine moiety, makes it indispensable for medicinal chemistry research and the development of novel active pharmaceutical ingredients (APIs). This compound is primarily sought by research institutions and pharmaceutical companies engaged in the discovery of new therapeutic agents, particularly in areas requiring sophisticated molecular scaffolds.

Application

• Pharmaceutical Intermediate: A key building block in the synthesis of novel drug candidates, especially for central nervous system (CNS) and metabolic disease targets.
• Medicinal Chemistry Research: Used in structure-activity relationship (SAR) studies and lead optimization due to its unique fluorinated heterocyclic core.
• API Development: Serves as a precursor in the multi-step synthesis of complex final active pharmaceutical ingredients.
• Biochemical Tool Compound: Potential use in probing biological pathways and as a ligand in biochemical assays.
• Custom Synthesis: A starting material for contract research organizations (CROs) and CDMOs performing bespoke chemical synthesis for clients.
• Agrochemical Research: Exploration of applications in developing new agrochemicals, leveraging the stability imparted by fluorine atoms.

Basic Information

Product Name	4-(2,4,6-Trifluorobenzyl)-1-([6-(Trifluoromethyl)Pyridin-3-Yl]Methyl)-1,4-Diazepan-5-One
CAS No.	909668-89-9
Molecular Formula	C19H16F6N3O
Molecular Weight	416.34 g/mol
Synonyms	1,4-Diazepan-5-one, 4-[(2,4,6-trifluorophenyl)methyl]-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-; 4-(2,4,6-Trifluorobenzyl)-1-((6-(trifluoromethyl)pyridin-3-yl)methyl)-1,4-diazepan-5-one; 909668-89-9; Fluorinated Diazepanone Intermediate; CAS 909668-89-9
EINECS	Contact for details

Quality Control

Every batch of 4-(2,4,6-Trifluorobenzyl)-1-([6-(Trifluoromethyl)Pyridin-3-Yl]Methyl)-1,4-Diazepan-5-One is manufactured and tested under strict quality management systems. We provide comprehensive analytical data to ensure the material meets the high-purity standards required for pharmaceutical research and development. A detailed Certificate of Analysis (COA) is supplied with each shipment, documenting identity, purity, and impurity profiles as determined by advanced chromatographic and spectroscopic methods.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (typically 15-25°C). The compound may be hygroscopic (moisture-sensitive); therefore, containers should be kept tightly sealed under an inert atmosphere if specified. Keep away from strong acids, bases, and oxidizing agents.

Specification

Item	Specification
Appearance	White to off-white solid
Identification (IR)	Conforms to structure
Identification (HPLC)	Retention time matches reference standard
Purity (HPLC)	≥ 97.0%
Water Content (KF)	≤ 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.