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(4R,6S)-6-[(E)-2-4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-ylvinyl]-2,2-dimethyl-1,3-dioxan-4-ylacetic acid is a complex organic compound characterized by its molecular formula C28H36FN3O6S. It features a dioxane ring, a pyrimidine ring, a phenyl group, and an isopropyl group. Additionally, the compound contains a double bond and a methylsulfonylamine group. Its structural complexity and the presence of various functional groups suggest that it may have potential pharmaceutical or biological applications, although further research and testing are required to determine its specific properties and uses.

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  • 894787-93-0 Structure
  • Basic information

    1. Product Name: {(4R,6S)-6-[(E)-2-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-yl}vinyl]-2,2-dimethyl-1,3-dioxan-4-yl}acetic acid
    2. Synonyms: {(4R,6S)-6-[(E)-2-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-yl}vinyl]-2,2-dimethyl-1,3-dioxan-4-yl}acetic acid
    3. CAS NO:894787-93-0
    4. Molecular Formula:
    5. Molecular Weight: 521.61
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 894787-93-0.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 700.5±70.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: N/A
    5. Density: 1.296±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: {(4R,6S)-6-[(E)-2-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-yl}vinyl]-2,2-dimethyl-1,3-dioxan-4-yl}acetic acid(CAS DataBase Reference)
    10. NIST Chemistry Reference: {(4R,6S)-6-[(E)-2-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-yl}vinyl]-2,2-dimethyl-1,3-dioxan-4-yl}acetic acid(894787-93-0)
    11. EPA Substance Registry System: {(4R,6S)-6-[(E)-2-{4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-yl}vinyl]-2,2-dimethyl-1,3-dioxan-4-yl}acetic acid(894787-93-0)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 894787-93-0(Hazardous Substances Data)

894787-93-0 Usage

Uses

Used in Pharmaceutical Industry:
(4R,6S)-6-[(E)-2-4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-ylvinyl]-2,2-dimethyl-1,3-dioxan-4-ylacetic acid is used as a potential pharmaceutical compound for its structural complexity and the presence of functional groups that may interact with biological systems. (4R,6S)-6-[(E)-2-4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-ylvinyl]-2,2-dimethyl-1,3-dioxan-4-ylacetic acid's potential applications in the pharmaceutical industry could include the development of new drugs or therapies, targeting specific diseases or conditions.
Used in Research and Development:
In the field of research and development, (4R,6S)-6-[(E)-2-4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-ylvinyl]-2,2-dimethyl-1,3-dioxan-4-ylacetic acid can be utilized as a starting material or a key intermediate in the synthesis of other complex organic molecules. Its unique structure and functional groups make it a valuable candidate for further exploration and experimentation, potentially leading to the discovery of new compounds with novel properties and applications.
Used in Chemical Synthesis:
(4R,6S)-6-[(E)-2-4-(4-fluorophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino]pyrimidin-5-ylvinyl]-2,2-dimethyl-1,3-dioxan-4-ylacetic acid may also find use in chemical synthesis, particularly in the production of other complex organic compounds. Its structural features and functional groups can be exploited to create a variety of new molecules with different properties and potential applications, contributing to the advancement of the chemical industry.

Check Digit Verification of cas no

The CAS Registry Mumber 894787-93-0 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 8,9,4,7,8 and 7 respectively; the second part has 2 digits, 9 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 894787-93:
(8*8)+(7*9)+(6*4)+(5*7)+(4*8)+(3*7)+(2*9)+(1*3)=260
260 % 10 = 0
So 894787-93-0 is a valid CAS Registry Number.

894787-93-0Relevant articles and documents

A novel process for synthesis of Rosuvastatin

Nagender Rao,Reddy, Reguri Buchi,Mukkanti,Konda, Venu

, p. 1018 - 1022 (2017/03/22)

A novel process for the preparation of antihypercholesterolemic drug rosuvastatin calcium using novel intermediates has been described. Novel intermediates have been characterized by using IR, NMR and Mass spectroscopy.

Stereocontrolled synthesis of rosuvastatin calcium via iodine chloride-induced intramolecular cyclization

Xiong, Fangjun,Wang, Haifeng,Yan, Lingjie,Han, Sheng,Tao, Yuan,Wu, Yan,Chen, Fener

, p. 1363 - 1369 (2016/02/03)

A novel, stereoselective approach towards rosuvastatin calcium from the known (S)-homoallylic alcohol has been developed. The synthesis is highlighted by a regio- and stereocontrolled ICl-induced intramolecular cyclization of chiral homoallylic carbonate to deliver the C6-formyl statin side chain with a syn-1,3-diol moiety. An improved synthesis of the rosuvastatin pyrimidine core moiety is also included. Moreover, this methodology is useful in the asymmetric synthesis of structural variants of statins such as pitavastatin calcium and atorvastatin calcium and their related analogs.

POLYMORPHS OF ROSUVASTATIN ACETONIDE CALCIUM ((3R,5S,6E)-7-[4-(4- FLUOROPHENYL)-6-ISOPROPYL-2-(METHANESULFONYL-METHYL-AMINO)-PYRIMN)IN-5- YL)VINYL)-2,2-DIMETHYL-L,3-DIOXAN-4-YL) ACETIC ACID CALCIUM SALT

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Page/Page column 14, (2012/04/10)

The present invention relates to crystalline forms and an amorphous form of Rosuvastatin Acetonide Calcium which is known by the systemic chemical name (3R,5S,6E)-7-[4-(4-Fluorophenyl)-6-isopropyl-2- (methanesulfonyl-methyl-amino)pyrimidin-5-yl)vinyl)-2,2

PROCESS FOR THE PREPARATION OF ROSUVASTATIN AND INTERMEDIATES

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Page/Page column 8, (2010/04/23)

The subject of the present invention is a process for the preparation of rosuvastatin by reacting a compound of formula II, by alkalic hydrolysis to give a compound of formula III, thereafter reacting with an organic or inorganic base to form a salt, eliminating the acetonide group and reacting with calcium-chloride in a base. A further subject of the present invention is a compound of formula III and its salts formed by organic or inorganic base.

A PROCESS FOR PREPARING HMG-COA REDUCTASE INHIBITORS AND INTERMEDIATES

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Page/Page column 37; 48-49, (2010/01/30)

The present invention relates to an improved process for synthesizing calcium salt of (E)-7-[4-(4-flurophenyl)-6-isopropyl-2-[methyl(methylsulfonyl)amino] pyrimidin-5-yl](3R,5S)-3,5-dihydroxy-6-heptenoic acid (Rosuvastatin Calcium) in high purity.

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