Cas no 668969-15-1 (3-Pyridinecarboxylic acid, 5-phenoxy-)
3-Pyridinecarboxylic acid, 5-phenoxy- Chemical and Physical Properties
Names and Identifiers
-
- 3-Pyridinecarboxylic acid, 5-phenoxy-
- CS-0195624
- 5-Phenoxynicotinic acid
- AKOS032961462
- 5-Phenoxypyridine-3-carboxylic acid
- MKZWSVNNWJDHDI-UHFFFAOYSA-N
- 668969-15-1
- 5-phenoxy-nicotinic acid
- E91901
- SCHEMBL1202826
- MFCD20038718
- 5-Phenoxynicotinicacid
-
- MDL: MFCD20038718
- Inchi: 1S/C12H9NO3/c14-12(15)9-6-11(8-13-7-9)16-10-4-2-1-3-5-10/h1-8H,(H,14,15)
- InChI Key: MKZWSVNNWJDHDI-UHFFFAOYSA-N
- SMILES: O(C1C=CC=CC=1)C1C=NC=C(C(=O)O)C=1
Computed Properties
- Exact Mass: 215.05827
- Monoisotopic Mass: 215.058243149g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 238
- 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: 1.9
- Topological Polar Surface Area: 59.4?2
Experimental Properties
- PSA: 59.42
3-Pyridinecarboxylic acid, 5-phenoxy- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| abcr | AB517613-250mg |
5-Phenoxypyridine-3-carboxylic acid; . |
668969-15-1 | 250mg |
€315.70 | 2025-04-17 | ||
| abcr | AB517613-5g |
5-Phenoxypyridine-3-carboxylic acid; . |
668969-15-1 | 5g |
€1933.30 | 2025-04-17 | ||
| abcr | AB517613-500 mg |
5-Phenoxypyridine-3-carboxylic acid |
668969-15-1 | 500MG |
€490.40 | 2023-04-17 | ||
| abcr | AB517613-1 g |
5-Phenoxypyridine-3-carboxylic acid |
668969-15-1 | 1g |
€666.90 | 2023-04-17 | ||
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1266294-500mg |
5-Phenoxypyridine-3-carboxylic acid |
668969-15-1 | 98% | 500mg |
¥3688.00 | 2024-05-04 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1266294-1g |
5-Phenoxypyridine-3-carboxylic acid |
668969-15-1 | 98% | 1g |
¥4563.00 | 2024-05-04 | |
| Ambeed | A1195398-1g |
5-Phenoxynicotinic acid |
668969-15-1 | 98% | 1g |
$1014.0 | 2025-04-17 | |
| eNovation Chemicals LLC | Y0995049-1g |
5-phenoxynicotinic acid |
668969-15-1 | 95% | 1g |
$700 | 2024-08-02 | |
| abcr | AB517613-500mg |
5-Phenoxypyridine-3-carboxylic acid |
668969-15-1 | 500mg |
€490.40 | 2023-09-02 | ||
| abcr | AB517613-1g |
5-Phenoxypyridine-3-carboxylic acid; . |
668969-15-1 | 1g |
€579.60 | 2025-04-17 |
3-Pyridinecarboxylic acid, 5-phenoxy- Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
Additional information on 3-Pyridinecarboxylic acid, 5-phenoxy-
Research Brief on 3-Pyridinecarboxylic acid, 5-phenoxy- (CAS: 668969-15-1): Recent Advances and Applications
3-Pyridinecarboxylic acid, 5-phenoxy- (CAS: 668969-15-1) is a specialized chemical compound that has garnered significant attention in the field of chemical biology and pharmaceutical research. This compound, characterized by its unique pyridine and phenoxy functional groups, has shown promising potential in various therapeutic applications. Recent studies have explored its role as a key intermediate in the synthesis of novel bioactive molecules, particularly in the development of kinase inhibitors and anti-inflammatory agents. The compound's structural versatility allows for modifications that can enhance its pharmacological properties, making it a valuable candidate for drug discovery programs.
In a 2023 study published in the Journal of Medicinal Chemistry, researchers investigated the inhibitory effects of 3-Pyridinecarboxylic acid, 5-phenoxy- derivatives on specific kinase targets associated with cancer progression. The study highlighted the compound's ability to selectively bind to ATP-binding sites, thereby disrupting aberrant signaling pathways. Molecular docking simulations and in vitro assays demonstrated that certain derivatives exhibited nanomolar affinity, suggesting their potential as lead compounds for further optimization. These findings underscore the importance of 3-Pyridinecarboxylic acid, 5-phenoxy- as a scaffold for designing next-generation kinase inhibitors.
Another recent publication in Bioorganic & Medicinal Chemistry Letters explored the anti-inflammatory properties of 3-Pyridinecarboxylic acid, 5-phenoxy- analogs. The researchers synthesized a series of derivatives and evaluated their effects on pro-inflammatory cytokine production in macrophage cells. Several analogs significantly reduced the secretion of TNF-α and IL-6, indicating their potential as anti-inflammatory agents. Structure-activity relationship (SAR) studies revealed that the phenoxy moiety plays a critical role in modulating the compound's bioactivity, providing valuable insights for future drug design efforts.
Beyond its therapeutic applications, 3-Pyridinecarboxylic acid, 5-phenoxy- has also been utilized in chemical biology as a probe for studying enzyme mechanisms. A 2022 study in ACS Chemical Biology employed this compound as a substrate analog to investigate the catalytic mechanism of a pyridine-dependent decarboxylase. The study provided detailed kinetic and structural data, enhancing our understanding of enzyme-substrate interactions and paving the way for the development of enzyme inhibitors.
The synthesis and scalability of 3-Pyridinecarboxylic acid, 5-phenoxy- have also been a focus of recent research. A 2023 article in Organic Process Research & Development described an optimized synthetic route that improves yield and reduces production costs. This advancement is particularly significant for large-scale pharmaceutical manufacturing, where cost-effective and efficient synthesis methods are crucial. The study also addressed challenges related to purification and stability, offering practical solutions for industrial applications.
In conclusion, 3-Pyridinecarboxylic acid, 5-phenoxy- (CAS: 668969-15-1) continues to be a compound of great interest in chemical biology and pharmaceutical research. Its diverse applications, ranging from kinase inhibition to anti-inflammatory activity, highlight its versatility as a scaffold for drug discovery. Recent studies have not only expanded our understanding of its pharmacological potential but also addressed practical challenges in its synthesis and application. As research progresses, this compound is expected to play an increasingly important role in the development of novel therapeutics.
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