Cas no 143210-48-4 (Ethyl 4-(pyridin-4-ylmethyl)piperazine-1-carboxylate)

Ethyl 4-(pyridin-4-ylmethyl)piperazine-1-carboxylate is a synthetic organic compound featuring a piperazine core substituted with a pyridinylmethyl group and an ethyl carboxylate moiety. This structure imparts versatility in medicinal chemistry and pharmaceutical research, particularly as a building block for drug discovery. The pyridine and piperazine functionalities enhance binding affinity to biological targets, making it valuable for developing receptor modulators or enzyme inhibitors. Its ester group offers synthetic flexibility for further derivatization. The compound’s well-defined reactivity and stability under standard conditions ensure consistent performance in heterocyclic synthesis. Suitable for use in high-throughput screening and lead optimization, it serves as a key intermediate in the design of bioactive molecules.
Ethyl 4-(pyridin-4-ylmethyl)piperazine-1-carboxylate structure
143210-48-4 structure
Product Name:Ethyl 4-(pyridin-4-ylmethyl)piperazine-1-carboxylate
CAS No:143210-48-4
MF:C14H20N2O2
MW:248.320803642273
CID:136284
PubChem ID:10083358
Update Time:2025-05-22

Ethyl 4-(pyridin-4-ylmethyl)piperazine-1-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 4-(pyridin-4-ylmethyl)piperazine-1-carboxylate
    • 1-Piperazinecarboxylicacid, 4-(4-pyridinylmethyl)-, ethyl ester
    • 1-Pyridin-4-ylmethylpiperidine-4-carboxylic acid ethyl ester
    • 4-(4-pyridylmethyl)-1-piperazinecarboxylic acid,ethyl ester
    • Pyridin-4-ylmethylpiperidine-4-carboxylic acid
    • 4-Piperidinecarboxylic acid, 1-(4-pyridinylmethyl)-, ethyl ester
    • 138030-54-3
    • AMY15351
    • Ethyl 1-[(pyridin-4-yl)methyl]piperidine-4-carboxylate
    • AKOS009073995
    • Ethyl 1-(pyridin-4-ylmethyl)piperidine-4-carboxylate
    • DTXSID40435377
    • 1-Pyridin-4-ylmethylpiperidine-4-carboxylic acid ethyl. ester
    • FT-0654408
    • 4-Piperidinecarboxylicacid, 1-(4-pyridinylmethyl)-, ethyl ester
    • ethyl 1-((pyridin-4-yl)methyl)piperidine-4-carboxylate
    • SCHEMBL12204641
    • FT-0741919
    • 143210-48-4
    • Ethyl4-(pyridin-4-ylmethyl)piperazine-1-carboxylate
    • DB-001599
    • Inchi: 1S/C14H20N2O2/c1-2-18-14(17)13-5-9-16(10-6-13)11-12-3-7-15-8-4-12/h3-4,7-8,13H,2,5-6,9-11H2,1H3
    • InChI Key: LSUOSTHKSMZNTN-UHFFFAOYSA-N
    • SMILES: O(CC)C(C1CCN(CC2C=CN=CC=2)CC1)=O

Computed Properties

  • Exact Mass: 248.15200
  • Monoisotopic Mass: 248.152477885g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 5
  • Complexity: 257
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.4
  • Topological Polar Surface Area: 42.4?2

Experimental Properties

  • PSA: 42.43000
  • LogP: 1.79460

Ethyl 4-(pyridin-4-ylmethyl)piperazine-1-carboxylate Customs Data

  • HS CODE:2933990090
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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Additional information on Ethyl 4-(pyridin-4-ylmethyl)piperazine-1-carboxylate

Ethyl 4-(pyridin-4-ylmethyl)piperazine-1-carboxylate: A Comprehensive Overview

Ethyl 4-(pyridin-4-ylmethyl)piperazine-1-carboxylate, with CAS No. 143210-48-4, is a compound of significant interest in the fields of organic chemistry and pharmacology. This compound is characterized by its unique structure, which combines a piperazine ring with a pyridine moiety and an ethoxy carboxylic acid ester group. The piperazine ring is a six-membered saturated ring containing two nitrogen atoms, while the pyridine group introduces aromaticity and potential for hydrogen bonding. The ethoxy carboxylic acid ester group adds to the compound's versatility, making it a valuable building block in various chemical reactions.

Recent studies have highlighted the importance of Ethyl 4-(pyridin-4-ylmethyl)piperazine-1-carboxylate in drug design and development. Its structure allows for easy functionalization, enabling researchers to explore its potential as a precursor for bioactive molecules. For instance, the compound has been utilized in the synthesis of novel antidepressants and neuroprotective agents, where the piperazine ring plays a crucial role in modulating pharmacokinetic properties such as solubility and bioavailability.

The synthesis of Ethyl 4-(pyridin-4-ylmethyl)piperazine-1-carboxylate involves a series of well-established organic reactions. Typically, the process begins with the preparation of piperazine derivatives, followed by alkylation to introduce the pyridine moiety. The final step involves esterification to attach the ethoxy carboxylic acid group. This multi-step synthesis ensures high purity and structural integrity, making it suitable for both academic research and industrial applications.

In terms of applications, Ethyl 4-(pyridin-4-ylmethyl)piperazine-1-carboxylate has found use in materials science as well. Its ability to form stable complexes with metal ions has led to its exploration in the development of coordination polymers and metal-organic frameworks (MOFs). These materials exhibit unique properties such as high surface area and porosity, making them ideal candidates for gas storage and catalysis.

Moreover, recent advancements in green chemistry have prompted researchers to investigate more sustainable methods for synthesizing Ethyl 4-(pyridin-4-ylmethyl)piperazine-1-carboxylate. Techniques such as microwave-assisted synthesis and enzymatic catalysis are being explored to reduce environmental impact while maintaining product quality. These efforts align with global initiatives to promote eco-friendly chemical processes.

The compound's stability under various conditions has also been a focal point of recent research. Studies have demonstrated that Ethyl 4-(pyridin-4-ylmethyl)piperazine-1-carboxylate exhibits excellent thermal stability, making it suitable for high-temperature applications. Additionally, its resistance to hydrolysis under physiological conditions enhances its potential as a drug candidate.

In conclusion, Ethyl 4-(pyridin-4-yLmethyl)piperazine -1 -carbox ylate (CAS No. 143210 -48 -4) is a versatile compound with wide-ranging applications in chemistry and pharmacology. Its unique structure, combined with recent advancements in synthesis and application techniques, positions it as a key player in modern chemical research. As ongoing studies continue to uncover new possibilities, this compound is poised to make significant contributions to both academic and industrial sectors.

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