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2-(2,4-difluorophenyl)-3-(4-(4-(2-(4-trifluoromethoxybenzyl)-2h-1,2,4-triazol-3-one-4-yl)phenyl)piperazin-1-yl)-1-(1h-1,2,4-triazol-1-yl)butan-2-ol

Description Research Excerpts Clinical Trials Roles Classes Pathways Study Profile Bioassays Related Drugs Related Conditions Protein Interactions Research Growth Market Indicators

Description

You've described a complex organic molecule with a very specific structure. While I can't provide a definitive answer about its specific importance, I can break down the structure and discuss its potential significance in research:

**Understanding the Structure:**

* **Key components:** This molecule is a complex combination of several functional groups:
* **Phenyl rings:** Multiple aromatic rings with fluorine substitutions (2,4-difluorophenyl and 4-(4-(2-(4-trifluoromethoxybenzyl)-2H-1,2,4-triazol-3-one-4-yl)phenyl)
* **Heterocyclic rings:** Triazole rings (1H-1,2,4-triazol-1-yl and 2H-1,2,4-triazol-3-one-4-yl)
* **Piperazine ring:** A six-membered ring containing nitrogen atoms.
* **Alcohol group:** A hydroxyl group (OH)
* **Substitutions:** This molecule has several fluorine substitutions, a trifluoromethoxybenzyl group, and a triazolone group. These features can significantly impact the molecule's properties.

**Possible Research Significance:**

Given its complex structure and multiple functional groups, this molecule could be relevant in several research areas, including:

* **Medicinal chemistry:**
* **Drug development:** The presence of heterocyclic rings, particularly triazoles, is often associated with biological activity and is frequently seen in drug candidates.
* **Targeting specific receptors:** The molecule's structure suggests it might bind to certain receptors or enzymes, potentially leading to therapeutic applications.
* **Antimicrobial activity:** Triazoles are known for their antimicrobial properties, and this molecule might exhibit similar activity.
* **Material science:** The combination of aromatic rings and functional groups could create a material with interesting properties, such as conductivity, fluorescence, or even self-assembly behavior.
* **Organic synthesis:** The molecule's structure serves as a building block for creating new and more complex molecules with potentially unique properties.

**How to Find More Information:**

To understand the specific research significance of this molecule, you would need to know:

* **Its purpose:** Was it synthesized for a specific application, like a drug candidate or a material component?
* **Its properties:** What are its physical and chemical properties, like solubility, melting point, or spectral data?
* **Published research:** Has this molecule been studied and published in scientific literature?

**Searching for Information:**

* **Chemical databases:** Databases like PubChem or ChemSpider might have information about the molecule if it has been registered.
* **Scientific journals:** Search for the molecule's name or related keywords in scientific databases like Scopus or Web of Science.
* **Patent databases:** If the molecule is associated with a patent, you can find information about its intended use.

Remember, understanding the specific context of this molecule is essential to fully appreciate its research significance.

Syn 2869: structure in first source [Medical Subject Headings (MeSH), National Library of Medicine, extracted Dec-2023]

Cross-References

ID SourceID
PubMed CID3081359
CHEMBL ID5194034
SCHEMBL ID1651314
MeSH IDM0304716

Synonyms (8)

Synonym
210562-98-4
3h-1,2,4-triazol-3-one, 4-(4-(4-((1r,2r)-2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1h-1,2,4-triazol-1-yl)propyl)-1-piperazinyl)phenyl)-2,4-dihydro-2-((4-(trifluoromethoxy)phenyl)methyl)-
2-(2,4-difluorophenyl)-3-(4-(4-(2-(4-trifluoromethoxybenzyl)-2h-1,2,4-triazol-3-one-4-yl)phenyl)piperazin-1-yl)-1-(1h-1,2,4-triazol-1-yl)butan-2-ol
syn 2869
SCHEMBL1651314
DTXSID80175280
CHEMBL5194034
heaoyzudbiusjn-jpzyqriqsa-n

Research Excerpts

Bioavailability

ExcerptReferenceRelevance
"34 microg/ml, respectively, in BALB/c mice after administration of an oral dose of 50 mg/kg of body weight, with bioavailability being greater than 45% in all mice."( Interspecies comparison of pharmacokinetics of the novel triazole antifungal agent SYN-2869 and its derivatives.
Bu, HZ; Daneshtalab, M; Khan, JK; Micetich, RG; Montaseri, H; Poglod, M; Salama, SM; Zuo, Z, 2000
)
0.31
[information is derived through text-mining from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Bioassays (1)

Assay IDTitleYearJournalArticle
AID1872497Antifungal activity against Aspergillus fumigatus2022European journal of medicinal chemistry, Mar-05, Volume: 231Synthetic approaches and structural diversity of triazolylbutanols derived from voriconazole in the antifungal drug development.
[information is prepared from bioassay data collected from National Library of Medicine (NLM), extracted Dec-2023]

Research

Studies (9)

TimeframeStudies, This Drug (%)All Drugs %
pre-19900 (0.00)18.7374
1990's4 (44.44)18.2507
2000's4 (44.44)29.6817
2010's0 (0.00)24.3611
2020's1 (11.11)2.80
[information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Market Indicators

Research Demand Index: 11.91

According to the monthly volume, diversity, and competition of internet searches for this compound, as well the volume and growth of publications, there is estimated to be weak demand-to-supply ratio for research on this compound.

MetricThis Compound (vs All)
Research Demand Index11.91 (24.57)
Research Supply Index2.30 (2.92)
Research Growth Index4.21 (4.65)
Search Engine Demand Index0.00 (26.88)
Search Engine Supply Index0.00 (0.95)

This Compound (11.91)

All Compounds (24.57)

Study Types

Publication TypeThis drug (%)All Drugs (%)
Trials0 (0.00%)5.53%
Reviews1 (11.11%)6.00%
Case Studies0 (0.00%)4.05%
Observational0 (0.00%)0.25%
Other8 (88.89%)84.16%
[information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023]