Cas no 1234616-15-9 (ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate)
ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate
- P12162
- ETHYL 4-CHLORO-6-AZAINDOLE-2-CARBOXYLATE
- DA-33897
- PB19589
- AS-51223
- 1H-Pyrrolo[2,3-c]pyridine-2-carboxylic acid, 4-chloro-, ethyl ester
- CS-0049466
- AKOS027254157
- ETHYL4-CHLORO-1H-PYRROLO[2,3-C]PYRIDINE-2-CARBOXYLATE
- 1234616-15-9
- MFCD17214394
- SCHEMBL24020846
-
- MDL: MFCD17214394
- Inchi: 1S/C10H9ClN2O2/c1-2-15-10(14)8-3-6-7(11)4-12-5-9(6)13-8/h3-5,13H,2H2,1H3
- InChI Key: GKVIEEJBFFRMMG-UHFFFAOYSA-N
- SMILES: ClC1=CN=CC2=C1C=C(C(=O)OCC)N2
Computed Properties
- Exact Mass: 224.0352552g/mol
- Monoisotopic Mass: 224.0352552g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 250
- 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: 2.2
- Topological Polar Surface Area: 55?2
Experimental Properties
- Density: 1.391±0.06 g/cm3 (20 oC 760 Torr),
- Solubility: Very slightly soluble (0.47 g/l) (25 o C),
ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM149752-250mg |
ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate |
1234616-15-9 | 95%+ | 250mg |
$627 | 2021-08-05 | |
| Chemenu | CM149752-1g |
ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate |
1234616-15-9 | 95%+ | 1g |
$1450 | 2021-08-05 | |
| Chemenu | CM149752-250mg |
ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate |
1234616-15-9 | 95%+ | 250mg |
$445 | 2023-11-21 | |
| Chemenu | CM149752-1g |
ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate |
1234616-15-9 | 95%+ | 1g |
$1115 | 2023-11-21 | |
| eNovation Chemicals LLC | D585482-100mg |
ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate |
1234616-15-9 | 97% | 100mg |
$205 | 2024-05-23 | |
| eNovation Chemicals LLC | D585482-250MG |
ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate |
1234616-15-9 | 97% | 250mg |
$325 | 2024-05-23 | |
| eNovation Chemicals LLC | D585482-500MG |
ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate |
1234616-15-9 | 97% | 500mg |
$545 | 2024-05-23 | |
| eNovation Chemicals LLC | D585482-1G |
ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate |
1234616-15-9 | 97% | 1g |
$815 | 2024-05-23 | |
| eNovation Chemicals LLC | D585482-5G |
ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate |
1234616-15-9 | 97% | 5g |
$2455 | 2024-05-23 | |
| eNovation Chemicals LLC | D585482-10G |
ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate |
1234616-15-9 | 97% | 10g |
$4090 | 2024-05-23 |
ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate Related Literature
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
Additional information on ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate
Recent Advances in the Study of Ethyl 4-Chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate (CAS: 1234616-15-9)
Ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate (CAS: 1234616-15-9) is a heterocyclic compound that has garnered significant attention in the field of chemical biology and medicinal chemistry due to its potential as a key intermediate in the synthesis of biologically active molecules. Recent studies have explored its applications in drug discovery, particularly in the development of kinase inhibitors and other therapeutic agents targeting various diseases, including cancer and inflammatory disorders.
One of the most notable advancements in the research of this compound is its role in the synthesis of novel pyrrolopyridine derivatives. These derivatives have demonstrated promising pharmacological properties, such as high selectivity and potency against specific kinase targets. For instance, a 2023 study published in the Journal of Medicinal Chemistry highlighted the use of ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate as a precursor in the development of inhibitors for the JAK-STAT signaling pathway, which is implicated in autoimmune diseases and cancer.
In addition to its pharmacological applications, recent research has also focused on optimizing the synthetic routes for ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate. A study in Organic Process Research & Development (2024) reported an improved, scalable synthesis method that enhances yield and purity while reducing environmental impact. This advancement is critical for facilitating large-scale production and further exploration of the compound's therapeutic potential.
Furthermore, computational studies have provided insights into the molecular interactions and binding affinities of derivatives of ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate. Molecular docking and dynamics simulations have revealed that these compounds exhibit strong binding to active sites of target proteins, supporting their potential as lead compounds in drug development. These findings were corroborated by in vitro assays, which showed significant inhibitory activity against specific cancer cell lines.
Despite these promising developments, challenges remain in the clinical translation of these compounds. Issues such as bioavailability, metabolic stability, and off-target effects need to be addressed in future studies. However, the ongoing research on ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate and its derivatives underscores its importance as a versatile scaffold in medicinal chemistry.
In conclusion, ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate (CAS: 1234616-15-9) continues to be a focal point in chemical biology and drug discovery. Its applications in kinase inhibitor development, coupled with advancements in synthetic methodologies and computational modeling, highlight its potential to contribute to the next generation of therapeutics. Future research should focus on addressing the remaining challenges to fully realize its clinical potential.
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