Cas no 1244949-71-0 (Methyl 4-chloro-1H-pyrrolo[3,2-c]pyridine-6-carboxylate)

Methyl 4-chloro-1H-pyrrolo[3,2-c]pyridine-6-carboxylate structure
1244949-71-0 structure
Product Name:Methyl 4-chloro-1H-pyrrolo[3,2-c]pyridine-6-carboxylate
CAS No:1244949-71-0
MF:C9H7ClN2O2
MW:210.617080926895
CID:1029012
PubChem ID:45480459
Update Time:2025-11-02

Methyl 4-chloro-1H-pyrrolo[3,2-c]pyridine-6-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 4-chloro-1H-pyrrolo[3,2-c]pyridine-6-carboxylate
    • DTXSID40670387
    • methyl4-chloro-1H-pyrrolo[3,2-c]pyridine-6-carboxylate
    • 1244949-71-0
    • 1H-Pyrrolo[3,2-c]pyridine-6-carboxylic acid, 4-chloro-, methyl ester
    • Inchi: 1S/C9H7ClN2O2/c1-14-9(13)7-4-6-5(2-3-11-6)8(10)12-7/h2-4,11H,1H3
    • InChI Key: FWVGFHICGCRVDI-UHFFFAOYSA-N
    • SMILES: ClC1C2C=CNC=2C=C(C(=O)OC)N=1

Computed Properties

  • Exact Mass: 210.0196052g/mol
  • Monoisotopic Mass: 210.0196052g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 237
  • 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: 2.1
  • Topological Polar Surface Area: 55?2

Methyl 4-chloro-1H-pyrrolo[3,2-c]pyridine-6-carboxylate Pricemore >>

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Additional information on Methyl 4-chloro-1H-pyrrolo[3,2-c]pyridine-6-carboxylate

Comprehensive Overview of Methyl 4-chloro-1H-pyrrolo[3,2-c]pyridine-6-carboxylate (CAS No. 1244949-71-0)

Methyl 4-chloro-1H-pyrrolo[3,2-c]pyridine-6-carboxylate (CAS No. 1244949-71-0) is a heterocyclic compound that has garnered significant attention in pharmaceutical and agrochemical research due to its unique structural properties. This compound belongs to the pyrrolopyridine family, a class of nitrogen-containing heterocycles known for their diverse biological activities. Researchers are increasingly exploring its potential as a building block for drug discovery, particularly in the development of kinase inhibitors and antimicrobial agents. The presence of both chloro and ester functional groups in its structure makes it a versatile intermediate for further chemical modifications.

In recent years, the demand for Methyl 4-chloro-1H-pyrrolo[3,2-c]pyridine-6-carboxylate has surged, driven by its applications in medicinal chemistry and material science. A common query among scientists is: "What are the synthetic routes for this compound?" The most widely reported method involves the cyclization of appropriately substituted pyridine derivatives, followed by esterification and chlorination. Another frequently asked question is: "How does this compound compare to other pyrrolopyridine derivatives?" Studies suggest that its electron-withdrawing chloro group enhances reactivity in nucleophilic substitution reactions, making it distinct from its analogs.

The compound's CAS No. 1244949-71-0 is often searched in conjunction with terms like "pyrrolopyridine scaffold", "kinase inhibitor synthesis", and "heterocyclic building blocks", reflecting its relevance in modern drug design. With the rise of AI-assisted molecular modeling, computational chemists are also investigating its binding affinity to various biological targets. Notably, its methyl ester moiety allows for straightforward hydrolysis, enabling the generation of carboxylic acid derivatives for further derivatization—a feature highly valued in combinatorial chemistry.

From an industrial perspective, Methyl 4-chloro-1H-pyrrolo[3,2-c]pyridine-6-carboxylate is manufactured under stringent quality control to ensure high purity for research use. Analytical techniques such as HPLC, NMR, and mass spectrometry are routinely employed to verify its identity and assess impurities. Environmental considerations are also paramount; recent publications highlight its biodegradability profile and low ecotoxicity, aligning with the growing emphasis on green chemistry principles in synthetic workflows.

Future research directions for this compound may explore its utility in photopharmacology—a cutting-edge field where light-sensitive drugs are activated at specific disease sites. Additionally, its potential role in metal-organic frameworks (MOFs) for catalytic applications is an emerging area of interest. As the scientific community continues to unravel the capabilities of CAS No. 1244949-71-0, its prominence in both academic and industrial settings is expected to grow exponentially.

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