306960-80-5 Usage
Description
2-Chloro-6-pentafluoroethyl-pyrimidine-4-carboxylic acid is a chemical compound with the molecular formula C7H3ClF5N2O2. It is an organic compound that contains a pyrimidine ring with a carboxylic acid and a pentafluoroethyl group. The presence of a chlorine atom at the 2-position of the pyrimidine ring gives the compound its chloro prefix.
Used in Pharmaceutical Industry:
2-Chloro-6-pentafluoroethyl-pyrimidine-4-carboxylic acid is used as a building block for the synthesis of various bioactive compounds. Its unique structure and functional groups make it a promising candidate for the development of new drugs with potential therapeutic applications.
Used in Agrochemical Industry:
2-Chloro-6-pentafluoroethyl-pyrimidine-4-carboxylic acid is also used as a building block for the synthesis of agrochemicals. Its potential as a precursor for the development of new pesticides or herbicides can contribute to more effective and targeted agricultural solutions.
It is important to handle and use this chemical compound with proper safety precautions and in accordance with all applicable regulations.
Check Digit Verification of cas no
The CAS Registry Mumber 306960-80-5 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 3,0,6,9,6 and 0 respectively; the second part has 2 digits, 8 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 306960-80:
(8*3)+(7*0)+(6*6)+(5*9)+(4*6)+(3*0)+(2*8)+(1*0)=145
145 % 10 = 5
So 306960-80-5 is a valid CAS Registry Number.
306960-80-5Relevant articles and documents
Inhibitors of NF-kappaB and AP-1 gene expression: SAR studies on the pyrimidine portion of 2-chloro-4-trifluoromethylpyrimidine-5-[N-(3', 5'-bis(trifluoromethyl)phenyl)carboxamide].
Palanki,Erdman,Gayo-Fung,Shevlin,Sullivan,Goldman,Ransone,Bennett,Manning,Suto
, p. 3995 - 4004 (2007/10/03)
We investigated the structure-activity relationship studies of N-[3, 5-bis(trifluoromethyl)phenyl][2-chloro-4-(trifluoromethyl)pyrimidin-5 -yl]carboxamide (1), an inhibitor of transcription mediated by both NF-kappaB and AP-1 transcription factors, with the goal of improving its potential oral bioavailability. Compounds were examined for cell-based activity, were fit to Lipinski's rule of 5, and were examined for potential gastrointestinal permeability using the intestinal epithelial cell line, Caco-2. Selected groups were substituted at the 2-, 4-, and 5-positions of the pyrimidine ring using solution-phase combinatorial methodology. The introduction of a fluorine in the place of 2-chlorine of 1 resulted in a compound with comparable activity. However, other substitutions at the 2-position resulted in a loss of activity. The trifluoromethyl group at the 4-position could be replaced with a methyl, ethyl, chlorine, or phenyl without a substantial loss of activity. The carboxamide group at the 5-position is critical for activity. If it was moved to the 6-position, the activity was lost. The 2-methyl analogue of 1 (81) showed comparable in vitro activity and improved Caco-2 permeability compared to 1.
