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1-(5-(4-chlorophenyl)-1H-pyrrol-2-yl)-2,2,2-trifluoroethan-1-one is a chemical compound with the molecular formula C14H8ClF3NO. It is a pyrrole derivative that features a 4-chlorophenyl group and a trifluoroethanone moiety. 1-(5-(4-chlorophenyl)-1H-pyrrol-2-yl)-2,2,2-trifluoroethan-1-one holds potential in the field of medicinal chemistry, particularly for the development of pharmaceuticals and agrochemicals. Its structural characteristics may allow it to interact with biological targets or enzymes, suggesting a range of possible biological activities. Further research is necessary to explore its properties and potential applications across various sectors.

91735-77-2

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91735-77-2 Usage

Uses

Used in Pharmaceutical Development:
1-(5-(4-chlorophenyl)-1H-pyrrol-2-yl)-2,2,2-trifluoroethan-1-one is used as a chemical intermediate for the synthesis of various pharmaceuticals. Its unique structure allows it to potentially interact with specific biological targets, making it a valuable compound in the development of new drugs.
Used in Agrochemical Development:
In the agrochemical industry, 1-(5-(4-chlorophenyl)-1H-pyrrol-2-yl)-2,2,2-trifluoroethan-1-one is used as a building block for the creation of novel agrochemicals. Its structural features may contribute to the development of more effective and targeted pesticides or other agricultural products.
Used in Medicinal Chemistry Research:
1-(5-(4-chlorophenyl)-1H-pyrrol-2-yl)-2,2,2-trifluoroethan-1-one is also utilized in medicinal chemistry research as a tool to study the interactions between small molecules and biological targets. Understanding these interactions can lead to the discovery of new therapeutic agents and a better comprehension of disease mechanisms.
Used in Chemical Synthesis:
1-(5-(4-chlorophenyl)-1H-pyrrol-2-yl)-2,2,2-trifluoroethan-1-one serves as a key component in the synthesis of more complex organic molecules. Its unique combination of functional groups makes it a versatile building block for creating a wide array of chemical products.

Check Digit Verification of cas no

The CAS Registry Mumber 91735-77-2 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 9,1,7,3 and 5 respectively; the second part has 2 digits, 7 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 91735-77:
(7*9)+(6*1)+(5*7)+(4*3)+(3*5)+(2*7)+(1*7)=152
152 % 10 = 2
So 91735-77-2 is a valid CAS Registry Number.

91735-77-2Relevant academic research and scientific papers

Synthesis of 5-Arylpyrrole-2-carboxylic Acids as Key Intermediates for NBD Series HIV-1 Entry Inhibitors

Belov, Dmitry S.,Ivanov, Vladimir N.,Curreli, Francesca,Kurkin, Alexander V.,Altieri, Andrea,Debnath, Asim K.

, p. 3692 - 3699 (2017/08/15)

5-Arylpyrrole-2-carboxylic acids are important key intermediates in the synthesis of HIV-1 entry inhibitors (such as NBD-11021 and NBD-14010). Here we present a general method for the synthesis of some 5-arylpyrrole-2-carboxylic acids in three steps starting from pyrrole. By this method, the compounds could be prepared on gram scale and without chromatographic purification.

Structure-Based Design of a Small Molecule CD4-Antagonist with Broad Spectrum Anti-HIV-1 Activity

Curreli, Francesca,Kwon, Young Do,Zhang, Hongtao,Scacalossi, Daniel,Belov, Dmitry S.,Tikhonov, Artur A.,Andreev, Ivan A.,Altieri, Andrea,Kurkin, Alexander V.,Kwong, Peter D.,Debnath, Asim K.

, p. 6909 - 6927 (2015/09/22)

Earlier we reported the discovery and design of NBD-556 and their analogs which demonstrated their potential as HIV-1 entry inhibitors. However, progress in developing these inhibitors has been stymied by their CD4-agonist properties, an unfavorable trait for use as drug. Here, we demonstrate the successful conversion of a full CD4-agonist (NBD-556) through a partial CD4-agonist (NBD-09027), to a full CD4-antagonist (NBD-11021) by structure-based modification of the critical oxalamide midregion, previously thought to be intolerant of modification. NBD-11021 showed unprecedented neutralization breath for this class of inhibitors, with pan-neutralization against a panel of 56 Env-pseudotyped HIV-1 representing diverse subtypes of clinical isolates (IC50 as low as 270 nM). The cocrystal structure of NBD-11021 complexed to a monomeric HIV-1 gp120 core revealed its detail binding characteristics. The study is expected to provide a framework for further development of NBD series as HIV-1 entry inhibitors for clinical application against AIDS.

Synthesis and optical properties of difluorobora-s-diazaindacene dyes with trifluoromethyl meso-substituents

Sobenina, Lyubov N.,Petrova, Olga V.,Petrushenko, Konstantin B.,Ushakov, Igor A.,Mikhaleva, Albina I.,Meallet-Renault, Rachel,Trofimov, Boris A.

, p. 4107 - 4118 (2013/07/19)

A series of meso-CF3-4,4-difluoro-4-bora-3a,4a-diaza-s-indacene (BODIPY) dyes with aryl and hetaryl substituents at the C-3 and C-5 positions, both symmetric and asymmetric, have been synthesized in 36-90 % yields by a new strategy involving as the key step the condensation of 2,2,2-trifluoro-1-(5- arylpyrrol-2-yl)-1-ethanols with diverse 2-arylpyrroles. The starting 2,2,2-trifluoro-1-(5-arylpyrrol-2-yl)-1-ethanols are easily prepared by reduction of the available 2-trifluoroacetyl-5-arylpyrroles. The synthesized dyes fluoresce in a longer wavelength region (626-698 nm) with high quantum yield (0.84-0.99). A new strategy for the synthesis of highly efficient symmetric and asymmetric BODIPY fluorophores that combine trifluoromethyl and 3,5-aryl substituents has been developed. The key step is the P 2O5-promoted condensation of 2,2,2-trifluoro-1-(5- arylpyrrol-2-yl)-1-ethanols with diverse 2-arylpyrroles. Copyright

PYRROLES FROM KETOXIMES AND ACETYLENE. 38. NEW REPRESENTATIVES OF TRIFLUOROACETYLPYRROLES. SYNTHESIS AND TRANSFORMATIONS

Korostova, S. E.,Mikhaleva, A. I.,Sobenina, L. N.,Shevchenko, S. G.,Sigalov, M. V.,et al.

, p. 39 - 43 (2007/10/02)

A series of previously unknown trifluoroacetyl derivatives of pyrroles were obtained with high yields by the reaction of pyrroles, including N-vinyl-substituted pyrroles, with trifluoroacetic anhydride in the presence of pyridine at room temperature.The s

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