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    CAS 1421372-94-2

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    CAS 1421372-94-2
    Also known as: 1421372-94-2, N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methylindol-3-yl)pyrimidin-2-amine, N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methyl-1h-indol-3-yl)-2-pyrimidinamine, Mfcd28167946, N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methyl-3-indolyl)-2-pyrimidinamine, Azd9291 intermediate 2
    Molecular Formula
    C20H16FN5O3
    Molecular Weight
    393.4  g/mol
    InChI Key
    SZTYQQYYIMVETL-UHFFFAOYSA-N
    1 2D Structure

    CAS 1421372-94-2

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methylindol-3-yl)pyrimidin-2-amine
    2.1.2 InChI
    InChI=1S/C20H16FN5O3/c1-25-11-13(12-5-3-4-6-17(12)25)15-7-8-22-20(23-15)24-16-10-18(26(27)28)14(21)9-19(16)29-2/h3-11H,1-2H3,(H,22,23,24)
    2.1.3 InChI Key
    SZTYQQYYIMVETL-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CN1C=C(C2=CC=CC=C21)C3=NC(=NC=C3)NC4=CC(=C(C=C4OC)F)[N+](=O)[O-]
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 1421372-94-2

    2. N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methylindol-3-yl)pyrimidin-2-amine

    3. N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methyl-1h-indol-3-yl)-2-pyrimidinamine

    4. Mfcd28167946

    5. N-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methyl-3-indolyl)-2-pyrimidinamine

    6. Azd9291 Intermediate 2

    7. Amy533

    8. Schembl14660648

    9. Azd9291 N-3

    10. Bcp13954

    11. Cs-m2844

    12. Akos027255196

    13. Zinc146443046

    14. Sb18082

    15. Ac-30105

    16. Da-45005

    17. Ds-10129

    18. Sy060360

    19. Ft-0726750

    20. W12008

    21. 2-pyrimidinamine,n-(4-fluoro-2-methoxy-5-nitrophenyl)-4-(1-methyl-1h-indol-3-yl)-

    22. N-(4-fluoro-2-methoxy-5-nitro-phenyl)-4-(1-methylindol-3-yl)-pyrimidin-2-amine

    23. N-(4-fluoro-2-methoxy-5-nitro-phenyl)-4-(1-methylindol-3-yl)pyrimidin-2-amine

    2.3 Create Date
    2013-03-21
    3 Chemical and Physical Properties
    Molecular Weight 393.4 g/mol
    Molecular Formula C20H16FN5O3
    XLogP33.7
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count7
    Rotatable Bond Count4
    Exact Mass393.12371755 g/mol
    Monoisotopic Mass393.12371755 g/mol
    Topological Polar Surface Area97.8 Ų
    Heavy Atom Count29
    Formal Charge0
    Complexity579
    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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    We are one of the well-known manufacturers of key APIs & intermediates in China, with 20 years of experie...
    We are one of the well-known manufacturers of key APIs & intermediates in China, with 20 years of experience & presence in 20+ countries. At Boyuan, we are committed to providing high-quality products & services. Formerly known as “Jinan Boyuan Chemical Co., Ltd” & “Shandong Boyuan Chemical Co., Ltd.” Boyuan was founded in June 2001. We have 2 manufacturing plants in the cities of Jiyang & Yucheng in Shandong Province, China & both are in line with the GMP standard, following a strict quality system & conforming with international standards. Boyuan is dedicated to anti-cancer, anti-fungal & other APIs & intermediates associated.
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        Shanghai fine pharma founded in 2014, is a professional enterprise with chemical reagents and fine chemic...
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