885590-98-7 Usage
Cyclic organic compound
Dioxolane ring This compound is a cyclic organic molecule containing a dioxolane ring, which is a five-membered ring with two oxygen atoms and three carbon atoms.
Phenyl group attachment
2,3-difluoro-4-iodophenyl A phenyl group is attached to the dioxolane ring, with two fluorine atoms at the 2 and 3 positions, and an iodine atom at the 4 position.
Distinct chemical properties
Difluoro and iodine atoms The presence of difluoro and iodine atoms in the phenyl group gives this compound unique chemical properties, affecting its reactivity and interactions with other molecules.
Applications
Pharmaceutical and agrochemical industries 2-(2,3-difluoro-4-iodophenyl)[1,3]dioxolane is commonly used as an intermediate or building block in the synthesis of various active ingredients in drugs and pesticides.
Property impartation
Specific properties to final products This compound is known for imparting specific properties to the final products, enhancing their effectiveness or modifying their characteristics.
Regulation
Environmental and health impacts The use of 2-(2,3-difluoro-4-iodophenyl)[1,3]dioxolane is regulated due to its potential environmental and health impacts, ensuring that its application does not pose significant risks to humans or the environment.
Check Digit Verification of cas no
The CAS Registry Mumber 885590-98-7 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 8,8,5,5,9 and 0 respectively; the second part has 2 digits, 9 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 885590-98:
(8*8)+(7*8)+(6*5)+(5*5)+(4*9)+(3*0)+(2*9)+(1*8)=237
237 % 10 = 7
So 885590-98-7 is a valid CAS Registry Number.
885590-98-7Relevant articles and documents
7-Fluoroindazoles as potent and selective inhibitors of factor Xa
Lee, Yu-Kai,Parks, Daniel J.,Lu, Tianbao,Thieu, Tho V.,Markotan, Thomas,Pan, Wenxi,McComsey, David F.,Milkiewicz, Karen L.,Crysler, Carl S.,Ninan, Nisha,Abad, Marta C.,Giardino, Edward C.,Maryanoff, Bruce E.,Damiano, Bruce P.,Player, Mark R.
, p. 282 - 297 (2008)
We have developed a novel series of potent and selective factor Xa inhibitors that employ a key 7-fluoroindazolyl moiety. The 7-fluoro group on the indazole scaffold replaces the carbonyl group of an amide that is found in previously reported factor Xa inhibitors. The structure of a factor Xa cocrystal containing 7-fluoroindazole 51a showed the 7-fluoro atom hydrogen-bonding with the N-H of Gly216 (2.9 ?) in the peptide backbone. Thus, the 7-fluoroindazolyl moiety not only occupied the same space as the carbonyl group of an amide found in prior factor Xa inhibitors but also maintained a hydrogen bond interaction with the protein's β-sheet domain. The structure-activity relationship for this series was consistent with this finding, as the factor Xa inhibitory potencies were about 60-fold greater (ΔΔG ≈ 2.4 kcal/mol) for the 7-fluoroindazoles 25a and 25c versus the corresponding indazoles 25b and 25d. Highly convergent synthesis of these factor Xa inhibitors is also described.
