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    Chemistry

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    Also known as: 871700-28-6, 6-amino-3-cyclopropyl-1-(2-fluoro-4-iodophenyl)pyrimidine-2,4-dione, 6-amino-3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-pyrimidine-2,4(1h,3h)-dione, Schembl1419390, Dtxsid80732731, Amy30042
    Molecular Formula
    C13H11FIN3O2
    Molecular Weight
    387.15  g/mol
    InChI Key
    WVVWGHZIHSJFNG-UHFFFAOYSA-N
    CAS 871700-28-6
    1 2D Structure

    CAS 871700-28-6

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    6-amino-3-cyclopropyl-1-(2-fluoro-4-iodophenyl)pyrimidine-2,4-dione
    2.1.2 InChI
    InChI=1S/C13H11FIN3O2/c14-9-5-7(15)1-4-10(9)18-11(16)6-12(19)17(13(18)20)8-2-3-8/h1,4-6,8H,2-3,16H2
    2.1.3 InChI Key
    WVVWGHZIHSJFNG-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CC1N2C(=O)C=C(N(C2=O)C3=C(C=C(C=C3)I)F)N
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 871700-28-6

    2. 6-amino-3-cyclopropyl-1-(2-fluoro-4-iodophenyl)pyrimidine-2,4-dione

    3. 6-amino-3-cyclopropyl-1-(2-fluoro-4-iodophenyl)-pyrimidine-2,4(1h,3h)-dione

    4. Schembl1419390

    5. Dtxsid80732731

    6. Amy30042

    7. Bcp15336

    8. Cs-m0420

    9. Wjb70028

    10. Mfcd18207183

    11. Zinc91302216

    12. Sb58751

    13. As-47066

    14. F11855

    15. 6-amino-3-cyclopropyl-1-(2-fluoro-4-iodo-phenyl)-1h-pyrimidine-2,4-dione

    2.3 Create Date
    2012-08-20
    3 Chemical and Physical Properties
    Molecular Weight 387.15 g/mol
    Molecular Formula C13H11FIN3O2
    XLogP31.8
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count2
    Exact Mass386.98800 g/mol
    Monoisotopic Mass386.98800 g/mol
    Topological Polar Surface Area66.6 Ų
    Heavy Atom Count20
    Formal Charge0
    Complexity480
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1

    BUILDING BLOCK

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    SUPPLIERS

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    01

    Ami Organics Private Limited

    India
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    6-AMINO-3-CYCLOPROPYL-1-(2-FLUORO-4-IODOPHENYL) P...

    CAS Number : 871700-28-6

    End Use API :

    End Use API : Trametinib

    About the Company : Founded with a mission to transform strategic capital into specialty chemicals, Ami Group focuses on Agrochemicals, Cosmetics, and Polymers. Ami Organics Ltd. is committed to meeting yo...

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    Guangdong Raffles PharmaTech Co Ltd

    China
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    6-amino-3-cyclopropyl-1-(2-fluoro-4-iodophenyl)pyr...

    CAS Number : 871700-28-6

    End Use API :

    End Use API : Trametinib

    About the Company : Established in August 2011, Raffles PharmaTech is a high-tech enterprise that focus on development, manufacturing and sales of high-value added active pharmaceutical ingredients and int...

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