Description

1H-Indole-1-Carboxylic Acid, 2-Borono-5-[[4-[2-[[(1,1-Dimethylethyl)Dimethylsilyl]Oxy]Ethyl]-1-Piperazinyl]Methyl]-, 1-(1,1-Dimethylethyl) Ester is a sophisticated, multi-functional organic compound featuring indole, boronic acid, and piperazine moieties, protected by tert-butyldimethylsilyl (TBDMS) and tert-butyl ester groups. This molecule is engineered as a key synthetic intermediate in advanced pharmaceutical research, particularly for the development of targeted therapies. It is primarily needed by R&D chemists and process development scientists in the pharmaceutical, biotechnology, and fine chemical sectors engaged in creating novel bioactive compounds.

Application

• Pharmaceutical Intermediate: Serves as a critical building block in the synthesis of complex drug candidates, especially those targeting specific enzymes or receptors.
• Protease Inhibitor Research: Used in the development of inhibitors for proteases like thrombin or factor Xa, leveraging the boronic acid group's affinity for serine residues.
• Bioconjugation and Probe Development: The reactive boronic acid functionality allows for use in creating molecular probes for diagnostic assays or targeted drug delivery systems.
• Medicinal Chemistry SAR Studies: Employed in structure-activity relationship (SAR) studies to optimize the pharmacokinetic and pharmacodynamic properties of lead compounds.
• Peptidomimetic Synthesis: Acts as a core scaffold in the design and synthesis of peptidomimetics, which are stable analogs of peptide-based drugs.
• Chemical Biology Tool Compound: Utilized as a tool compound to study biological pathways and protein functions in academic and industrial research settings.

Basic Information

Product Name	1H-Indole-1-Carboxylic Acid, 2-Borono-5-[[4-[2-[[(1,1-Dimethylethyl)Dimethylsilyl]Oxy]Ethyl]-1-Piperazinyl]Methyl]-, 1-(1,1-Dimethylethyl) Ester
CAS No.	913388-70-2
Molecular Formula	C29H48BN3O5Si
Molecular Weight	557.60 g/mol
Synonyms	2-Borono-5-[[4-[2-[[(1,1-Dimethylethyl)dimethylsilyl]oxy]ethyl]-1-piperazinyl]methyl]-1H-indole-1-carboxylic acid 1,1-dimethylethyl ester; tert-Butyl 2-borono-5-((4-(2-((tert-butyldimethylsilyl)oxy)ethyl)piperazin-1-yl)methyl)-1H-indole-1-carboxylate; TBDMS-protected Boronic Acid Indole Ester; Protease Inhibitor Intermediate BOC-913388-70-2; (1-(tert-Butoxycarbonyl)-5-((4-(2-((tert-butyldimethylsilyl)oxy)ethyl)piperazin-1-yl)methyl)-1H-indol-2-yl)boronic acid
EINECS	Contact for details

Quality Control

Our high-purity batch of this advanced intermediate is produced under strict quality management systems. Each lot undergoes comprehensive analytical characterization using NMR (1H, 13C), HPLC, and mass spectrometry to confirm identity and purity. We provide a detailed Certificate of Analysis (COA) with every shipment, ensuring traceability and compliance with your research and development protocols.

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) and must be handled under an inert atmosphere (e.g., nitrogen or argon) when opening the primary container to prevent degradation. 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)	≥ 95.0%
Water Content (KF)	≤ 1.0%
Residual Solvents (GC)	Meets ICH guidelines

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