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    N3-4-piperidinyl-2,3-pyridinediamine 2HCl manufacturers and suppliers on PharmaCompass

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    BUILDING BLOCK

    PharmaCompass

    Chemistry

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    Also known as: Schembl12469771, Db-085230, 1373116-08-5
    Molecular Formula
    C10H18Cl2N4
    Molecular Weight
    265.18  g/mol
    InChI Key
    UHLJULSYFLEASQ-UHFFFAOYSA-N
    N3-4-piperidinyl-2,3-pyridinediamine 2HCl
    1 2D Structure

    N3-4-piperidinyl-2,3-pyridinediamine 2HCl

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    3-N-piperidin-4-ylpyridine-2,3-diamine;dihydrochloride
    2.1.2 InChI
    InChI=1S/C10H16N4.2ClH/c11-10-9(2-1-5-13-10)14-8-3-6-12-7-4-8;;/h1-2,5,8,12,14H,3-4,6-7H2,(H2,11,13);2*1H
    2.1.3 InChI Key
    UHLJULSYFLEASQ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    C1CNCCC1NC2=C(N=CC=C2)N.Cl.Cl
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. Schembl12469771

    2. Db-085230

    3. 1373116-08-5

    2.3 Create Date
    2012-11-30
    3 Chemical and Physical Properties
    Molecular Weight 265.18 g/mol
    Molecular Formula C10H18Cl2N4
    Hydrogen Bond Donor Count5
    Hydrogen Bond Acceptor Count4
    Rotatable Bond Count2
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area63
    Heavy Atom Count16
    Formal Charge0
    Complexity168
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count3

    BUILDING BLOCK

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