Cas no 1185304-81-7 (2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine dihydrochloride)

2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine dihydrochloride is a dihydrochloride salt derivative of a benzyl-substituted isoindoline amine. This compound is of interest in medicinal chemistry and pharmaceutical research due to its potential as a building block for bioactive molecules. The dihydrochloride form enhances solubility and stability, facilitating handling and formulation in experimental applications. Its structural features, including the benzyl and isoindoline moieties, make it a versatile intermediate for synthesizing compounds with potential pharmacological activity. The high purity and well-defined chemical properties ensure reproducibility in research settings, supporting its use in drug discovery and development.
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine dihydrochloride structure
1185304-81-7 structure
Product Name:2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine dihydrochloride
CAS No:1185304-81-7
MF:C15H18Cl2N2
MW:297.222821712494
MDL:MFCD09997601
CID:1070987
PubChem ID:46735937
Update Time:2025-08-03

2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine dihydrochloride Chemical and Physical Properties

Names and Identifiers

    • 2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine dihydrochloride
    • 2-benzyl-1,3-dihydroisoindol-5-amine;dihydrochloride
    • SB65833
    • 1185304-81-7
    • 2-Benzylisoindolin-5-amine dihydrochloride
    • AKOS015844946
    • 2-Benzylisoindolin-5-aminedihydrochloride
    • 2-Benzyl-2,3-dihydro-1H-isoindol-5-ylaminedihydrochloride
    • 2-benzyl-1,3-dihydroisoindol-5-amine dihydrochloride
    • MDL: MFCD09997601
    • Inchi: 1S/C15H16N2.2ClH/c16-15-7-6-13-10-17(11-14(13)8-15)9-12-4-2-1-3-5-12;;/h1-8H,9-11,16H2;2*1H
    • InChI Key: GMDLLONWGJFMMR-UHFFFAOYSA-N
    • SMILES: Cl.Cl.N1(CC2C=CC=CC=2)CC2C=CC(=CC=2C1)N

Computed Properties

  • Exact Mass: 296.085
  • Monoisotopic Mass: 296.085
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 247
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 29.3A^2

2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine dihydrochloride Pricemore >>

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Additional information on 2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine dihydrochloride

Compound CAS No. 1185304-81-7: 2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine Dihydrochloride

The compound with CAS No. 1185304-81-7, known as 2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine dihydrochloride, is a fascinating molecule that has garnered significant attention in the fields of organic chemistry and pharmacology. This compound belongs to the class of isoindole derivatives, which are known for their unique structural features and diverse biological activities. The isoindole core of this molecule is a bicyclic structure that contributes to its stability and reactivity, making it a valuable compound for various applications.

Recent studies have highlighted the potential of 2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine dihydrochloride in drug discovery. Researchers have explored its ability to act as a scaffold for developing new therapeutic agents. For instance, its amine group has been shown to participate in hydrogen bonding interactions, which are crucial for binding to biological targets such as enzymes and receptors. This property makes it a promising candidate for designing drugs targeting diseases like cancer, inflammation, and neurodegenerative disorders.

The synthesis of this compound involves a multi-step process that typically begins with the preparation of the isoindole skeleton. One common approach is the cyclization of an appropriate diamine or amine derivative under specific conditions. The benzyl group attached to the isoindole ring adds complexity to the molecule and enhances its lipophilicity, which is an important factor for drug bioavailability. Advanced techniques such as microwave-assisted synthesis and catalytic methods have been employed to optimize the synthesis process, ensuring higher yields and better purity.

In terms of chemical properties, 2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine dihydrochloride exhibits interesting behavior in various reaction conditions. Its dihydrochloride form indicates that it exists as a salt in aqueous solutions, which affects its solubility and stability. Studies have shown that this compound can undergo further functionalization reactions, such as alkylation or acylation, to introduce additional functional groups. These modifications can potentially expand its application range and improve its pharmacokinetic profile.

The biological evaluation of this compound has revealed intriguing results. In vitro assays have demonstrated its ability to inhibit certain kinases and proteases, which are key players in various pathological processes. For example, its inhibitory effects on tyrosine kinases suggest potential applications in anti-cancer therapy. Additionally, preliminary toxicity studies indicate that this compound has a favorable safety profile at therapeutic concentrations, making it a viable option for further preclinical development.

From an industrial perspective, the production of 2-Benzyl-2,3-dihydro-1H-isoindol-5-yli amine dihydrochloride requires careful consideration of scalability and cost-effectiveness. The use of renewable resources and green chemistry principles has become increasingly important in modern synthesis routes. Researchers are exploring the use of biocatalysts and environmentally friendly solvents to reduce the environmental footprint of this compound's production process.

In conclusion, 2-Benzyl-2,3-dihydro -1H -isoindol -5 -yli amine dihydrochloride (CAS No. 1185304 -81 -7) is a versatile compound with significant potential in drug discovery and chemical synthesis. Its unique structure and functional groups make it an attractive target for further research and development. As new insights into its properties continue to emerge, this compound is poised to play a pivotal role in advancing both academic research and industrial applications.

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