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    Vamifeport

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    2D Structure
    Also known as: Vit-2763, 2095668-10-1, Vamifeport [inn], Vamifeport [usan], Fuf66ud0kr, 2-[2-[2-(1h-benzimidazol-2-yl)ethylamino]ethyl]-n-[(3-fluoropyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide
    Molecular Formula
    C21H21FN6O2
    Molecular Weight
    408.4  g/mol
    InChI Key
    KNYVRFXIVWUGBZ-UHFFFAOYSA-N
    FDA UNII
    FUF66UD0KR
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-[2-[2-(1H-benzimidazol-2-yl)ethylamino]ethyl]-N-[(3-fluoropyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide
    2.1.2 InChI
    InChI=1S/C21H21FN6O2/c22-14-4-3-9-24-17(14)12-25-21(29)18-13-30-20(28-18)8-11-23-10-7-19-26-15-5-1-2-6-16(15)27-19/h1-6,9,13,23H,7-8,10-12H2,(H,25,29)(H,26,27)
    2.1.3 InChI Key
    KNYVRFXIVWUGBZ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1=CC=C2C(=C1)NC(=N2)CCNCCC3=NC(=CO3)C(=O)NCC4=C(C=CC=N4)F
    2.2 Other Identifiers
    2.2.1 UNII
    FUF66UD0KR
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Vit-2763

    2.3.2 Depositor-Supplied Synonyms

    1. Vit-2763

    2. 2095668-10-1

    3. Vamifeport [inn]

    4. Vamifeport [usan]

    5. Fuf66ud0kr

    6. 2-[2-[2-(1h-benzimidazol-2-yl)ethylamino]ethyl]-n-[(3-fluoropyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide

    7. Vit-2763-pm1

    8. 2-(2-((2-(1h-benzimidazol-2-yl)ethyl)amino)ethyl)-n-((3-fluoropyridin-2-yl)methyl)-1,3-oxazole-4-carboxamide

    9. 4-oxazolecarboxamide, 2-(2-((2-(1h-benzimidazol-2-yl)ethyl)amino)ethyl)-n-((3-fluoro-2-pyridinyl)methyl)-

    10. Unii-fuf66ud0kr

    11. Chembl4596566

    12. Schembl18764615

    13. Gtpl11183

    14. Vit2763

    15. Ex-a4401

    16. Vit 2763

    17. Who 11410

    18. Hy-112220

    19. Cs-0044182

    2.4 Create Date
    2017-08-04
    3 Chemical and Physical Properties
    Molecular Weight 408.4 g/mol
    Molecular Formula C21H21FN6O2
    XLogP31.9
    Hydrogen Bond Donor Count3
    Hydrogen Bond Acceptor Count7
    Rotatable Bond Count9
    Exact Mass408.17100210 g/mol
    Monoisotopic Mass408.17100210 g/mol
    Topological Polar Surface Area109 Ų
    Heavy Atom Count30
    Formal Charge0
    Complexity556
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1