Description

Benzoic Acid, 5-[[[(2S)-2-Amino-3-(1H-Indol-3-yl)-1-oxopropyl]amino]methyl]-2-[[2-[(2-carboxyphenyl)amino]-5-(trifluoromethyl)phenyl]amino]- is a specialized, high-purity synthetic organic compound designed for advanced research and development applications. This molecule is valued for its complex structure, which incorporates key pharmacophores including a benzoic acid core, a tryptophan derivative, and a trifluoromethyl aniline moiety, making it a critical intermediate in pharmaceutical discovery, particularly for targeted therapies. It is primarily utilized by research institutions, biotechnology firms, and pharmaceutical companies engaged in the synthesis of novel bioactive molecules and drug candidates.

Application

• Pharmaceutical Intermediate: Serves as a key building block in the synthesis of novel drug candidates, especially in oncology and neurology research.
• Protease Inhibitor Research: Used in the development and screening of potential enzyme inhibitors due to its peptide-like and aromatic structure.
• Chemical Biology Probes: Acts as a scaffold or precursor for creating molecular probes to study protein-protein interactions and cellular signaling pathways.
• Medicinal Chemistry: Employed in structure-activity relationship (SAR) studies to optimize the potency and selectivity of lead compounds.
• High-Throughput Screening (HTS): Utilized as a reference standard or test compound in libraries for biological activity assays.
• Custom Synthesis: Provides a starting point for contract research organizations (CROs) and custom synthesis laboratories to produce tailored derivatives.

Basic Information

Product Name	Benzoic Acid, 5-[[[(2S)-2-Amino-3-(1H-Indol-3-yl)-1-oxopropyl]amino]methyl]-2-[[2-[(2-carboxyphenyl)amino]-5-(trifluoromethyl)phenyl]amino]-
CAS No.	721882-92-4
Molecular Formula	C34H28F3N5O5
Molecular Weight	643.61 g/mol
Synonyms	5-[[(2S)-2-Amino-3-(1H-indol-3-yl)propanamido]methyl]-2-[[2-[(2-carboxyphenyl)amino]-5-(trifluoromethyl)phenyl]amino]benzoic acid; N-[(2S)-2-Amino-3-(1H-indol-3-yl)propyl]-5-[[2-[[2-[(2-carboxyphenyl)amino]-5-(trifluoromethyl)phenyl]amino]benzoyl]amino]pentanamide (related structure); Tryptophan-benzoic acid-trifluoromethyl aniline conjugate; CAS 721882-92-4; Pharmaceutical Intermediate 721882-92-4; Benzoic acid derivative with tryptophan and CF3-aniline.
EINECS	Contact for details

Quality Control

This high-value compound is manufactured under strict quality control protocols to ensure batch-to-batch consistency and purity suitable for research applications. Quality is verified 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 batch to support your regulatory and research documentation needs.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry place at a controlled room temperature (15-25°C). This compound is hygroscopic (moisture-sensitive); ensure the container is sealed under an inert atmosphere if specified and kept in a low-humidity environment to maintain stability and purity.

Specification

Item	Specification
Appearance	White to off-white solid
Identification (HPLC)	Conforms to reference standard
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 95.0%
Water Content (KF)	≤ 2.0%
Residual Solvents (GC)	Meets ICH guidelines

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