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    Technical details about SRA737, learn more about the structure, uses, toxicity, action, side effects and more

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    SRA737

    DEVELOPMENTS

    PharmaCompass

    Farmhispania Group, a leading European CDMO in HPAPI Technologies & High Potency Fermentation.

    One Pharma aims to be one of the leading generic companies in Europe.

    2D Structure
    1. Also known as: Cct245737, 1489389-18-5, Cct-245737, Qb6lnl4nf6, Sra737, Sra-737 [who-sdg]
    Molecular Formula
    C16H16F3N7O
    Molecular Weight
    379.34  g/mol
    InChI Key
    YBYYWUUUGCNAHQ-LLVKDONJSA-N
    FDA UNII
    QB6LNL4NF6
    Chk1 Inhibitor SRA737 is an orally bioavailable inhibitor of checkpoint kinase 1 (chk1), with potential antineoplastic and chemosensitization activities. Upon oral administration, chk1 inhibitor SRA737 selectively binds to chk1, thereby preventing chk1 activity and abrogating the repair of damaged DNA. This may lead to an accumulation of damaged DNA, inhibition of cell cycle arrest, and induction of apoptosis. SRA737 may potentiate the cytotoxicity of DNA-damaging agents and reverse tumor cell resistance to chemotherapeutic agents. Chk1, an adenosine triphosphate (ATP)-dependent serine/threonine kinase overexpressed in a variety of cancer cell types, mediates cell cycle checkpoint control and is essential for DNA repair; it plays a key role in resistance to chemotherapeutic agents by repairing DNA damage.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    5-[[4-[[(2R)-morpholin-2-yl]methylamino]-5-(trifluoromethyl)pyridin-2-yl]amino]pyrazine-2-carbonitrile
    2.1.2 InChI
    InChI=1S/C16H16F3N7O/c17-16(18,19)12-8-25-14(26-15-9-22-10(4-20)5-24-15)3-13(12)23-7-11-6-21-1-2-27-11/h3,5,8-9,11,21H,1-2,6-7H2,(H2,23,24,25,26)/t11-/m1/s1
    2.1.3 InChI Key
    YBYYWUUUGCNAHQ-LLVKDONJSA-N
    2.1.4 Canonical SMILES
    C1COC(CN1)CNC2=CC(=NC=C2C(F)(F)F)NC3=NC=C(N=C3)C#N
    2.1.5 Isomeric SMILES
    C1CO[C@H](CN1)CNC2=CC(=NC=C2C(F)(F)F)NC3=NC=C(N=C3)C#N
    2.2 Other Identifiers
    2.2.1 UNII
    QB6LNL4NF6
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 5-((4-((morpholin-2-ylmethyl)amino)-5-(trifluoromethyl)pyridin-2-yl)amino)pyrazine-2-carbonitrile

    2. Cct245737

    2.3.2 Depositor-Supplied Synonyms

    1. Cct245737

    2. 1489389-18-5

    3. Cct-245737

    4. Qb6lnl4nf6

    5. Sra737

    6. Sra-737 [who-sdg]

    7. Pnt-737

    8. Sra-737

    9. 2-pyrazinecarbonitrile, 5-((4-(((2r)-2-morpholinylmethyl)amino)-5-(trifluoromethyl)-2-pyridinyl)amino)-

    10. Unii-qb6lnl4nf6

    11. Gtpl9187

    12. Chembl4169078

    13. Schembl15392098

    14. Us9663503, Compound 1

    15. Bdbm328993

    16. Sra737; Pnt-737

    17. Ex-a1607

    18. Mfcd30489721

    19. Nsc793726

    20. Zinc205442186

    21. Ccg-268393

    22. Compound 4 [pmid: 27167172]

    23. Cs-5863

    24. Nsc-793726

    25. Cct-245737?

    26. Ac-36122

    27. Bs-15458

    28. Hy-18958

    29. J3.603.159j

    30. Q27075794

    31. (r)5-((4-((morpholin-2-ylmethyl)amino)-5-(trifluoromethyl)pyridin-2-yl)amino)pyrazine-2-carbonitrile

    32. (r)a?-((4-((morpholin-2-ylmethyl)amino)-5-(trifluoromethyl)pyridin-2-yl)amino)pyrazine-2-carbonitrile

    33. 5-[(4-{[(2r)-morpholin-2-ylmethyl]amino}-5-(trifluoromethyl)pyridin-2-yl)amino]pyrazine-2-carbonitrile

    34. 5-[[4-[[(2r)-morpholin-2-yl]methylamino]-5-(trifluoromethyl)-2-pyridyl]amino]pyrazine-2-carbonitrile

    35. 5-[[4-[[(2r)-morpholin-2-yl]methylamino]-5-(trifluoromethyl)pyridin-2-yl]amino]pyrazine-2-carbonitrile

    2.4 Create Date
    2013-12-02
    3 Chemical and Physical Properties
    Molecular Weight 379.34 g/mol
    Molecular Formula C16H16F3N7O
    XLogP31.1
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count11
    Rotatable Bond Count5
    Exact Mass379.13684265 g/mol
    Monoisotopic Mass379.13684265 g/mol
    Topological Polar Surface Area108 Ų
    Heavy Atom Count27
    Formal Charge0
    Complexity526
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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