54399-03-0 Usage
Uses
Used in Organic Synthesis:
2-(prop-2-yn-1-yl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione is used as a building block in organic synthesis for the creation of various pharmaceutical compounds. Its unique structure and reactivity allow for the development of novel molecules with potential therapeutic applications.
Used in Drug Discovery Research:
In the pharmaceutical industry, 2-(prop-2-yn-1-yl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione is utilized as a key component in drug discovery research. Its potential biological activities and versatility in chemical reactions make it a promising candidate for the development of new drugs and therapeutic agents.
Used in Medicinal Chemistry:
2-(prop-2-yn-1-yl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione is employed as a valuable tool in medicinal chemistry, where its unique properties contribute to the design and synthesis of innovative pharmaceutical compounds with improved efficacy and selectivity.
Used in Chemical Biology Research:
2-(prop-2-yn-1-yl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione also finds application in chemical biology research, where it can be used to study the interactions between small molecules and biological targets, providing insights into the development of new therapeutic strategies and understanding the underlying mechanisms of diseases.
Check Digit Verification of cas no
The CAS Registry Mumber 54399-03-0 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,4,3,9 and 9 respectively; the second part has 2 digits, 0 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 54399-03:
(7*5)+(6*4)+(5*3)+(4*9)+(3*9)+(2*0)+(1*3)=140
140 % 10 = 0
So 54399-03-0 is a valid CAS Registry Number.
54399-03-0Relevant academic research and scientific papers
Design, Synthesis, and Potency of Pyruvate Dehydrogenase Complex E1 Inhibitors against Cyanobacteria
Zhou, Yuan,Feng, Jiangtao,He, Hongwu,Hou, Leifeng,Jiang, Wen,Xie, Dan,Feng, Lingling,Cai, Meng,Peng, Hao
, p. 6491 - 6502 (2017/12/26)
Safe and effective algaecides are needed to control agriculturally and environmentally significant algal species. Four series (6, 10, 17, and 21) of 29 novel 4-aminopyrimidine derivatives were rationally designed and synthesized. A part of 10, 17, and 21 displayed potent inhibition of Escherichia coli pyruvate dehydrogenase complex E1 (E. coli PDHc-E1) (IC50 = 2.12-18.06 μM) and good inhibition of Synechocystis sp. PCC 6803 (EC50 = 0.7-7.1 μM) and Microcystis sp. FACH 905 (EC50 = 3.7-7.6 μM). The algaecidal activity of these compounds positively correlated with their inhibition of E. coli PDHc-E1. In particular, 21l and 10b exhibited potent algaecidal activity against PCC 6803 (EC50 = 0.7 and 0.8 μM, respectively), values that were 2-fold increased compared to that of copper sulfate (EC50 = 1.8 μM), and showed the best inhibition of cyanobacterium PDHc-E1 (IC50 = 5.10 and 6.06 μM, respectively). 17h and 21e, the best inhibitors of E. coli PDHc-E1, were studied by molecular docking, site-directed mutagenesis, and enzymatic assays. These results revealed that the improved inhibition of novel inhibitors compared with that of the lead compound I was due to the formation of a new hydrogen bond with Leu264 at the active site of E. coli PDHc-E1. The results proved the great potential to obtain effective algaecides via the rational design of PDHc-E1 inhibitors. [Figure Presented]
