Description

3-(1,4-Diazepan-1-Yl)Benzo[D]Isothiazole is a specialized heterocyclic compound that serves as a valuable building block in advanced organic synthesis. Its unique fused-ring structure containing both diazepane and benzisothiazole moieties makes it a critical intermediate for the development of novel pharmacologically active molecules. This high-purity intermediate is primarily sought by research institutions and pharmaceutical companies engaged in medicinal chemistry and drug discovery programs.

Application

• Pharmaceutical Intermediate: A key precursor in the synthesis of novel drug candidates targeting central nervous system (CNS) disorders, such as anxiolytics or antipsychotics.
• Medicinal Chemistry Research: Used as a core scaffold for structure-activity relationship (SAR) studies and library synthesis in early-stage drug discovery.
• Agrochemical Development: Serves as a building block for creating new active ingredients in crop protection products.
• Chemical Biology Probes: Utilized in the design and synthesis of molecular probes for studying biological pathways and protein interactions.
• Material Science Research: Investigated as a monomer or additive for creating specialty polymers with unique electronic or optical properties.

Basic Information

Product Name	3-(1,4-Diazepan-1-Yl)Benzo[D]Isothiazole
CAS No.	99748-44-4
Molecular Formula	C13H15N3S
Molecular Weight	245.34 g/mol
Synonyms	3-(1,4-Diazepan-1-yl)-1,2-benzisothiazole; 3-(1,4-Diazepan-1-yl)benzo[d]isothiazole; Benzo[d]isothiazole, 3-(1,4-diazepan-1-yl)-; 99748-44-4; 3-(1,4-Diazepan-1-yl)benzisothiazole; 3-(Homopiperazin-1-yl)benzo[d]isothiazole
EINECS	Contact for details

Quality Control

Our 3-(1,4-Diazepan-1-Yl)Benzo[D]Isothiazole is manufactured under strict quality control protocols to ensure batch-to-batch consistency and high purity, essential for sensitive research and development applications. We provide comprehensive Certificates of Analysis (COA) with each shipment, detailing purity, identity, and impurity profiles. Our quality management system is designed to meet the stringent requirements of pharmaceutical and advanced chemical research customers.

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). Due to its hygroscopic (moisture-sensitive) nature, the container must be kept tightly sealed after opening to prevent degradation from atmospheric moisture. Keep away from incompatible materials.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Water Content (KF)	≤ 1.0%
Residue on Ignition	≤ 0.1%

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