Description

2-Mercapto-3-Phenyl-3,5,6,7,8,9-Hexahydro-10-Thia-1,3-Diaza-Benzo[A]Azulen-4-One is a complex heterocyclic compound featuring a fused thiadiazazulene core structure, which is of significant interest in advanced organic synthesis and pharmaceutical research. Its unique molecular architecture, incorporating sulfur and nitrogen heteroatoms, makes it a valuable key intermediate for developing novel active pharmaceutical ingredients (APIs) and functional materials. This compound is primarily utilized by research institutions and chemical manufacturers in the pharmaceutical, agrochemical, and specialty chemical sectors for creating new molecules with potential biological activity.

Application

• Pharmaceutical Intermediate: Serves as a critical building block in the synthesis of novel drug candidates, particularly those targeting central nervous system (CNS) disorders or possessing anti-inflammatory properties.
• Agrochemical Research: Used in the development of new pesticides or herbicides, leveraging its heterocyclic structure for bioactivity.
• Material Science: Potential precursor for organic electronic materials or ligands in catalytic systems due to its conjugated system and heteroatom content.
• Chemical Biology: Acts as a probe or scaffold in medicinal chemistry for structure-activity relationship (SAR) studies.
• Academic & R&D: Employed in university and industrial research laboratories for methodological studies in heterocyclic chemistry and new reaction development.

Basic Information

Product Name	2-Mercapto-3-Phenyl-3,5,6,7,8,9-Hexahydro-10-Thia-1,3-Diaza-Benzo[A]Azulen-4-One
CAS No.	59898-71-4
Molecular Formula	C20H18N2OS2
Molecular Weight	366.50 g/mol
Synonyms	3-Phenyl-2-thioxo-2,3,5,6,7,8,9,10-octahydro-1H-10-thia-1,3-diaza-benzo[a]azulen-4-one; 2-Mercapto-3-phenyl-3,5,6,7,8,9-hexahydro-10-thia-1,3-diazabenzo[a]azulen-4-one; Thiadiazazulene derivative; CAS 59898-71-4
EINECS	Contact for details

Quality Control

Our production of 2-Mercapto-3-Phenyl-3,5,6,7,8,9-Hexahydro-10-Thia-1,3-Diaza-Benzo[A]Azulen-4-One adheres to stringent quality protocols to ensure batch-to-batch consistency and high purity, essential for sensitive research and synthesis applications. Each lot is characterized using advanced analytical techniques including HPLC, NMR, and mass spectrometry. A comprehensive Certificate of Analysis (COA) detailing identity, purity, and impurity profiles is provided with every shipment to support your quality assurance 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 (15-25°C). Due to its sensitivity to oxidation, it is recommended to store the material under an inert atmosphere (e.g., nitrogen or argon) for long-term preservation. Keep away from heat, sparks, and open flame.

Specification

Item	Specification
Appearance	Yellow to light brown crystalline powder
Identification (IR)	Conforms to structure
Identification (HPLC)	Retention time matches reference standard
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.