Description

n-(1,1-Dimethylethyl)-3-[[5-Methyl-2-[[4-[2-(1-Pyrrolidinyl)Ethoxy]Phenyl]Amino]-4-Pyrimidinyl]Amino]Benzenesulfonamide Hydrochloride Hydrate (1:2:1) is a high-purity, non-stoichiometric hydrate salt form of a complex sulfonamide-based small molecule. This compound is of significant interest for its role as a key pharmaceutical intermediate or reference standard in advanced research and development. It is primarily required by organizations engaged in the discovery and synthesis of novel therapeutic agents, particularly within oncology and targeted therapy programs.

Application

• Pharmaceutical Intermediate: Serves as a critical building block in the multi-step synthesis of potential drug candidates for clinical research.
• Biochemical Research: Used as a reference standard or tool compound in enzymatic assays and target validation studies.
• Preclinical Development: Employed in formulation studies, pharmacokinetic (PK) profiling, and early-stage toxicology assessments.
• Academic Research: Utilized in universities and research institutes for investigating structure-activity relationships (SAR) and novel chemical pathways.
• Quality Control & Analytical Testing: Acts as a certified reference material (CRM) for method development and validation in analytical laboratories.
• Process Chemistry: Used for scaling up synthetic routes and optimizing manufacturing processes under GMP-like conditions.

Basic Information

Product Name	n-(1,1-Dimethylethyl)-3-[[5-Methyl-2-[[4-[2-(1-Pyrrolidinyl)Ethoxy]Phenyl]Amino]-4-Pyrimidinyl]Amino]Benzenesulfonamide Hydrochloride Hydrate (1:2:1)
CAS No.	1374744-69-0
Molecular Formula	C28H39N6O3S · 2HCl · H2O
Molecular Weight	Contact for details
Synonyms	BIRB 796 Dihydrochloride Hydrate; Doramapimod Dihydrochloride Hydrate; BIRB 0796 Dihydrochloride Hydrate; p38 MAP Kinase Inhibitor (BIRB 796) Dihydrochloride Hydrate; 3-tert-Butyl-N-[2-[[4-[2-(pyrrolidin-1-yl)ethoxy]phenyl]amino]-5-methylpyrimidin-4-yl]benzenesulfonamide dihydrochloride hydrate
EINECS	Contact for details

Quality Control

Our products undergo rigorous quality testing to ensure compliance with industry standards. Every batch is characterized using advanced analytical techniques including HPLC, NMR, and mass spectrometry to confirm identity, purity, and stoichiometry. Certificates of Analysis (COA) detailing batch-specific results are available upon request. We support development under GMP-grade requirements for advanced applications.

Storage

Preserve in a tightly closed container, protected from light. Store at controlled room temperature (15-25°C) or as indicated on the label or COA. This material is hygroscopic (moisture-sensitive) and must be kept in a dry environment. For long-term storage, consider desiccated conditions.

Specification

Item	Specification
Appearance	White to off-white solid
Identification (HPLC)	Conforms to reference standard
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥98.0%
Water Content (KF)	As per stoichiometry
Residual Solvents (GC)	Complies with ICH guidelines
Heavy Metals	<10 ppm

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