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Racemic-(2R,3As,7Ar)-1-Benzyl 5-tert-Butyl 2-(Aminomethyl)Hexahydro-1H-Pyrrolo[3,2-C]Pyridine-1,5(6H)-Dicarboxylate(Wx110492) CAS NO 1250993-13-5
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CAS No.:1250993-13-5
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
Racemic-(2R,3As,7Ar)-1-Benzyl 5-tert-Butyl 2-(Aminomethyl)Hexahydro-1H-Pyrrolo[3,2-C]Pyridine-1,5(6H)-Dicarboxylate (Wx110492) is a complex, multi-functional chiral pyrrolopyridine derivative, serving as a critical advanced pharmaceutical intermediate (API) and a versatile building block in organic synthesis. Its intricate fused bicyclic structure with protected amine and carboxylate groups makes it invaluable for constructing sophisticated molecular architectures. This compound is primarily sought after by pharmaceutical R&D teams and fine chemical manufacturers engaged in developing new therapeutic agents, particularly in the areas of neurology and oncology.
Application
- Key Intermediate in Drug Discovery & Development: Serves as a core scaffold for synthesizing novel bioactive molecules targeting G-protein-coupled receptors (GPCRs) and enzymes.
- Pharmaceutical Active Ingredient (API) Synthesis: Used in the multi-step synthesis of potential drug candidates, especially those requiring a rigid, polycyclic amine framework.
- Asymmetric Catalysis & Chiral Pool Building Block: The racemic mixture provides a source of chiral centers for further resolution and use in stereoselective synthesis.
- Medicinal Chemistry Research: Employed in structure-activity relationship (SAR) studies to optimize potency and selectivity of lead compounds.
- Peptidomimetic & Constrained Analogue Design: Its structure is ideal for mimicking peptide turn motifs, useful in designing metabolically stable drug analogues.
- Contract Research & Manufacturing (CRO/CMO): Supplied to service organizations supporting global pharmaceutical pipelines with custom synthetic chemistry.
Basic Information
| Item | Detail |
|---|---|
| Product Name | Racemic-(2R,3As,7Ar)-1-Benzyl 5-tert-Butyl 2-(Aminomethyl)Hexahydro-1H-Pyrrolo[3,2-C]Pyridine-1,5(6H)-Dicarboxylate (Wx110492) |
| CAS No. | 1250993-13-5 |
| Molecular Formula | C22H33N3O4 |
| Molecular Weight | 403.52 g/mol |
| Synonyms | 1,5(6H)-Dicarboxylic acid, 2-(aminomethyl)hexahydro-1H-pyrrolo[3,2-c]pyridine-, 1-(phenylmethyl) 5-(1,1-dimethylethyl) ester, (2R,3aS,7aR)-rel-; Wx110492; 1-Benzyl 5-tert-butyl 2-(aminomethyl)hexahydro-1H-pyrrolo[3,2-c]pyridine-1,5-dicarboxylate; rel-(2R,3aS,7aR)-1-Benzyl 5-tert-butyl 2-(aminomethyl)hexahydro-1H-pyrrolo[3,2-c]pyridine-1,5-dicarboxylate; tert-Butyl 2-(aminomethyl)-1-(benzyloxycarbonyl)hexahydro-1H-pyrrolo[3,2-c]pyridine-5-carboxylate; Pyrrolopyridine derivative Wx110492. |
| EINECS | Contact for details |
Quality Control
Our Racemic-(2R,3As,7Ar)-1-Benzyl 5-tert-Butyl 2-(Aminomethyl)Hexahydro-1H-Pyrrolo[3,2-C]Pyridine-1,5(6H)-Dicarboxylate (Wx110492) is manufactured under strict quality management systems. Each batch undergoes comprehensive analytical testing, including HPLC for purity and chiral analysis, NMR for structural confirmation, and MS for identity verification. We provide a detailed Certificate of Analysis (COA) with every shipment, ensuring traceability and compliance with your research or cGMP starting material requirements. Specifications are aligned with ICH guidelines for impurities.
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 should be handled under anhydrous conditions or a dry inert atmosphere to maintain stability and purity. Keep the container tightly sealed when not in use.
Specification
| Item | Specification |
|---|---|
| Appearance | White to off-white solid |
| Identification (IR) | Conforms to structure |
| Identification (NMR) | Conforms to structure |
| Purity (HPLC) | ≥ 97.0% |
| Chiral Purity (Chiral HPLC) | Racemic mixture (50:50) |
| Water Content (KF) | ≤ 1.0% |
| Residue on Ignition | ≤ 0.5% |
| Heavy Metals | ≤ 20 ppm |
Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.
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