36778-56-0Relevant academic research and scientific papers
[...] amine derivatives, preparation method and application thereof (by machine translation)
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Paragraph 0048-0051, (2018/11/27)
The invention discloses a [...] amine derivatives, preparation method and its application, which belongs to the technical field of pharmaceutical chemistry. The invention thymol as parent modify, through the nitration reaction obtaining the intermediate 2 - isopropyl - 5 - methyl - 4 - nitro-phenol. On this basis to perform the derivative, prepared four [...] amine derivatives. Specific performance for introducing electronegative weaker nitrogen atom, solves the problem of further derivatization; alkylation reaction to raise the compound film breathability and bioavailability; triphenylphosphine the introduction of group enhances the drug is targeted. The final four-benzoquinone imine derivatives can eliminate the excessive reactive oxygen species in cells (ROS), and maintaining the cell in the redox balance, inhibit the oxidative stress caused by the inflammation reaction; and can effectively induce apoptosis of inflammatory cells, to reduce inflammation reaction effect cell, demonstrate a certain anti-inflammatory superior pharmacological activity. (by machine translation)
Identification and structure-activity relationship study of carvacrol derivatives as Mycobacterium tuberculosis chorismate mutase inhibitors
Alokam, Reshma,Jeankumar, Variam Ullas,Sridevi, Jonnalagadda Padma,Matikonda, Siddharth Sai,Peddi, Santosh,Alvala, Mallika,Yogeeswari, Perumal,Sriram, Dharmarajan
, p. 547 - 554 (2014/08/05)
In the present study, we identified carvacrol, a major phenolic component of oregano oil as a novel small molecule inhibitor of Mycobacterium tuberculosis (MTB) chorismate mutase (CM) enzyme with IC50 of 1.06±0.4μM. Virtual screening of the BITS-Pilani in-house database using the crystal structure of the MTB CM bound transition state intermediate (PDB: 2FP2) as framework identified carvacrol as a potential lead. Further various carvacrol derivatives were evaluated in vitro for their ability to inhibit MTB CM enzyme, whole cell MTB and cytotoxicity as steps toward the derivation of structure-activity relationships (SAR) and lead optimization.
