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    CAS 1231930-37-2

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    CAS 1231930-37-2
    Also known as: 1231930-37-2, 1h-benzimidazole, 4-fluoro-2-methyl-1-(1-methylethyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, (4-fluoro-1-isopropyl-2-methyl-1h-benzo[d]imidazol-6-yl)boronic acid pinacol ester, 4-fluoro-2-methyl-1-propan-2-yl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzimidazole, 4-fluoro-2-methyl-1-(1-methylethyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-benzimidazole, 4-fluoro-2-methyl-1-(propan-2-yl)-6-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-1,3-benzodiazole
    Molecular Formula
    C17H24BFN2O2
    Molecular Weight
    318.2  g/mol
    InChI Key
    HUSPISQCNSLJSR-UHFFFAOYSA-N
    1 2D Structure

    CAS 1231930-37-2

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    4-fluoro-2-methyl-1-propan-2-yl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzimidazole
    2.1.2 InChI
    InChI=1S/C17H24BFN2O2/c1-10(2)21-11(3)20-15-13(19)8-12(9-14(15)21)18-22-16(4,5)17(6,7)23-18/h8-10H,1-7H3
    2.1.3 InChI Key
    HUSPISQCNSLJSR-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C(=C2)F)N=C(N3C(C)C)C
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 1231930-37-2

    2. 1h-benzimidazole, 4-fluoro-2-methyl-1-(1-methylethyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-

    3. (4-fluoro-1-isopropyl-2-methyl-1h-benzo[d]imidazol-6-yl)boronic Acid Pinacol Ester

    4. 4-fluoro-2-methyl-1-propan-2-yl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzimidazole

    5. 4-fluoro-2-methyl-1-(1-methylethyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-benzimidazole

    6. 4-fluoro-2-methyl-1-(propan-2-yl)-6-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-1,3-benzodiazole

    7. Ly2835219-intermediate-4

    8. Schembl2511865

    9. Dtxsid801114022

    10. Amy12372

    11. Bcp14849

    12. Cs-m2090

    13. Mfcd25977327

    14. Akos025404836

    15. Zinc204073456

    16. Ds-8915

    17. Sb15066

    18. Db-106812

    19. A890841

    20. 4-fluoro-1-isopropyl-2-methylbenzimidazole-6-boronic Acid Pinacol Ester

    21. 4-fluoro-1-isopropyl-2-methyl-1h-benzo[d]imidazole-6-boronic Acid Pinacol Ester

    22. 1-isopropyl-2-methyl-4-fluoro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)-1h-benzoimidazole

    23. 1h-benzimidazole,4-fluoro-2-methyl-1-(1-methylethyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-

    2.3 Create Date
    2012-11-30
    3 Chemical and Physical Properties
    Molecular Weight 318.2 g/mol
    Molecular Formula C17H24BFN2O2
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count2
    Exact Mass318.1914863 g/mol
    Monoisotopic Mass318.1914863 g/mol
    Topological Polar Surface Area36.3 Ų
    Heavy Atom Count23
    Formal Charge0
    Complexity444
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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      Porton Pharma Solutions

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      Porton Pharma Solutions Ltd. was founded in 2005, & the company's stock was successfully listed in Shenzh...
      Porton Pharma Solutions Ltd. was founded in 2005, & the company's stock was successfully listed in Shenzhen Stock Exchange in 2014. Our R&D, manufacturing & operation facilities are located in China, Slovenia, the US, Belgium, Switzerland, Denmark, with more than 6000 employees worldwide. Porton leads the way with its excellent CDMO services, but also supplies APIs & intermediates for the treatment of critical diseases such as HIV/AIDS, diabetes, cancer, & influenza. Our Process Technology Centers & WHO/USFDA/EMA/PDMA/NMPA-inspected Facilities feature state-of-the-art equipment, highly flexible cGMP-compliant production assets.
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        Prajna is an innovation driven pharmaceutical company. We dedicated to Research, Process development and ...
        Prajna is an innovation driven pharmaceutical company. We dedicated to Research, Process development and Manufacturing APIs and Advanced Intermediates for Active Pharmaceutical Ingredients (APIs) for the global pharmaceutical companies. It provides value-added services in Contract Research, Custom Synthesis, and Specialties Scientific technology (Green Process, APIs Process Development, Polymorphism, Crystallisation and Purification) for Pharmaceutical and Life Sciences industry.
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          Prajna is an innovation driven pharmaceutical company. We dedicated to Research, Process development and Manufacturing APIs and Advanced Intermediates for Active Pharmaceutical Ingredients (APIs) for the global pharmaceutical companies. It provides value-added services in Contract Research, Custom Synthesis, and Specialties Scientific technology (Green Process, APIs Process Development, Polymorphism, Crystallisation and Purification) for Pharmaceutical and Life Sciences industry.
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