Description

n-(1-Azepanylcarbonothioyl)-4-tert-Butylbenzamide is a specialized organic compound featuring a benzamide core functionalized with a thiourea linkage to an azepane ring. This molecular architecture makes it a valuable intermediate in advanced organic synthesis, particularly for constructing complex pharmacophores and functional materials. It is primarily sought by research and development chemists in the pharmaceutical and agrochemical industries for the development of new active ingredients and novel chemical entities.

Application

• Pharmaceutical Intermediate: Serves as a key building block in the synthesis of novel drug candidates, particularly those targeting neurological or metabolic pathways.
• Agrochemical Research: Used in the development of new herbicides, fungicides, or plant growth regulators that require specific thiourea-based bioactive cores.
• Chemical Biology Probe: Acts as a precursor for molecules designed to study enzyme inhibition or protein-ligand interactions due to its hydrogen-bonding thiourea moiety.
• Material Science: Potential intermediate in the synthesis of specialty polymers or ligands for metal-organic frameworks (MOFs) and catalysts.
• Custom Synthesis & Contract Manufacturing: Supplied to CDMOs (Contract Development and Manufacturing Organizations) for client-specific synthetic projects requiring high-purity, complex intermediates.

Basic Information

Product Name	n-(1-Azepanylcarbonothioyl)-4-tert-Butylbenzamide
CAS No.	642981-82-6
Molecular Formula	C18H26N2OS
Molecular Weight	318.48 g/mol
Synonyms	4-tert-Butyl-N-[(azepan-1-yl)carbothioyl]benzamide; 1-(4-tert-Butylbenzoyl)-3-(azepan-1-yl)thiourea; N-(azepan-1-ylcarbamothioyl)-4-(tert-butyl)benzamide; 4-(tert-Butyl)-N-[(azepan-1-yl)carbothioyl]benzamide; Azepane-1-carbothioic acid N-(4-tert-butylbenzoyl)amide; 642981-82-6
EINECS	Contact for details

Quality Control

Every batch of n-(1-Azepanylcarbonothioyl)-4-tert-Butylbenzamide is produced and tested under a strict quality management system. We ensure high purity and batch-to-batch consistency through advanced analytical techniques including HPLC, NMR, and mass spectrometry. A comprehensive Certificate of Analysis (COA) detailing identity, purity, 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 place at a controlled room temperature (typically 15-25°C). Keep away from strong oxidizing agents. For long-term storage, consider storing under an inert atmosphere to maximize stability.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
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%

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