Description

1H-Indole-1-carboxylic acid, 2,2'-[tricyclo[8.2.2.24,7]hexadeca-4,6,10,12,13,15-hexaene-5,11-diylbis(1H-benzimidazole-6,2-diyl)]bis[octahydro-, 1,1'-bis(1,1-dimethylethyl) ester, (2S,2'S,3aS,3'aS,7aS,7'aS)- is a sophisticated chiral organic compound characterized by a complex, rigid polycyclic framework integrating indole and benzimidazole moieties. This high-purity, non-racemic building block is engineered for advanced applications in pharmaceutical research and specialty chemical synthesis, where precise stereochemistry and molecular architecture are critical. It serves as a key intermediate for medicinal chemists and R&D scientists developing novel therapeutics, particularly in areas requiring complex, three-dimensional scaffolds for drug discovery.

Application

• Pharmaceutical Intermediate: A critical chiral building block for the synthesis of novel active pharmaceutical ingredients (APIs), especially in oncology and central nervous system (CNS) drug discovery programs.
• Advanced Organic Synthesis: Used in the construction of complex polyheterocyclic compounds for academic and industrial research, leveraging its rigid, pre-organized structure.
• Ligand and Catalyst Development: Serves as a precursor for creating specialized chiral ligands and organocatalysts used in asymmetric synthesis.
• Material Science Research: Potential monomer or precursor for developing novel organic electronic materials or polymers with specific optoelectronic properties.
• Bioconjugation and Probe Synthesis: Useful in creating chemical probes for biochemical and diagnostic applications due to its functionalizable indole core.

Basic Information

Product Name	1H-Indole-1-carboxylic acid, 2,2'-[tricyclo[8.2.2.24,7]hexadeca-4,6,10,12,13,15-hexaene-5,11-diylbis(1H-benzimidazole-6,2-diyl)]bis[octahydro-, 1,1'-bis(1,1-dimethylethyl) ester, (2S,2'S,3aS,3'aS,7aS,7'aS)-
CAS No.	1415120-54-5
Molecular Formula	C54H56N6O4
Molecular Weight	852.06 g/mol
Synonyms	(2S,2'S,3aS,3'aS,7aS,7'aS)-1,1'-Di-tert-butyl 2,2'-(5,11-dihydrotricyclo[8.2.2.2⁴,⁷]hexadeca-4,6,10,12,13,15-hexaene-5,11-diyl)bis(1H-benzimidazole-6,2-diyl))bis(octahydro-1H-indole-1-carboxylate); CAS 1415120-54-5; Chiral Indole-Benzimidazole Conjugate; tert-Butyl Protected Indole-Benzimidazole Dimer; Polycyclic Chiral Ester.
EINECS	Contact for details

Quality Control

This high-value chiral intermediate is manufactured under strict quality control protocols to ensure batch-to-batch consistency and high enantiomeric purity. Our products undergo rigorous analytical testing, including chiral HPLC, to confirm identity and purity. Certificates of Analysis (COA) detailing specific results for each lot are provided and available upon request, supporting compliance with research and development standards.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry place at a controlled room temperature (15-25°C). The compound is moisture-sensitive; keep the container tightly sealed in a dry environment. For long-term storage, consider storing under an inert atmosphere.

Specification

Item	Specification
Appearance	White to off-white solid
Identification (IR)	Conforms to structure
Identification (HPLC)	Conforms to reference
Purity (HPLC)	≥ 97.0%
Enantiomeric Purity (Chiral HPLC)	≥ 99.0% ee
Water Content (KF)	≤ 0.5%
Residue on Ignition	≤ 0.1%

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