loader
Please Wait
Applying Filters...

AbbVie Header AbbVie Header

X
menu

    Market Place

    Market Place

    Post Enquiry

    Post Enquiry
    menu

    Technical details about Adefovir & Pmpa, learn more about the structure, uses, toxicity, action, side effects and more

    Client Email Product
    Menu

    Adefovir & Pmpa

    APIs // Active Pharmaceutical Ingredients

    PharmaCompass

    Naprod is a top player in Oncology & Anesthesia FDF through excellent innovation, discovery of new processes & high-quality production.

    Skyepharma, an Expert and Innovative CDMO Partner for tailor-made solutions in complex oral solids and bioproduction.

    2D Structure
    1. Also known as: Schembl5170507, 9-(2-phosphonylmethoxyethyl)adenine & 9-(2-phosphonylmethoxypropyl)adenine, 2-(6-aminopurin-9-yl)ethoxymethylphosphonic acid; [(1r)-2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methylphosphonic acid
    Molecular Formula
    C17H26N10O8P2
    Molecular Weight
    560.4  g/mol
    InChI Key
    AQZIPWNQCGTDIV-FYZOBXCZSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-(6-aminopurin-9-yl)ethoxymethylphosphonic acid;[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethylphosphonic acid
    2.1.2 InChI
    InChI=1S/C9H14N5O4P.C8H12N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14;9-7-6-8(11-3-10-7)13(4-12-6)1-2-17-5-18(14,15)16/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17);3-4H,1-2,5H2,(H2,9,10,11)(H2,14,15,16)/t6-;/m1./s1
    2.1.3 InChI Key
    AQZIPWNQCGTDIV-FYZOBXCZSA-N
    2.1.4 Canonical SMILES
    CC(CN1C=NC2=C(N=CN=C21)N)OCP(=O)(O)O.C1=NC(=C2C(=N1)N(C=N2)CCOCP(=O)(O)O)N
    2.1.5 Isomeric SMILES
    C[C@H](CN1C=NC2=C(N=CN=C21)N)OCP(=O)(O)O.C1=NC(=C2C(=N1)N(C=N2)CCOCP(=O)(O)O)N
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. Schembl5170507

    2. 9-(2-phosphonylmethoxyethyl)adenine & 9-(2-phosphonylmethoxypropyl)adenine

    3. 2-(6-aminopurin-9-yl)ethoxymethylphosphonic Acid; [(1r)-2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methylphosphonic Acid

    2.3 Create Date
    2005-08-01
    3 Chemical and Physical Properties
    Molecular Weight 560.4 g/mol
    Molecular Formula C17H26N10O8P2
    Hydrogen Bond Donor Count6
    Hydrogen Bond Acceptor Count16
    Rotatable Bond Count10
    Exact Mass560.14103182 g/mol
    Monoisotopic Mass560.14103182 g/mol
    Topological Polar Surface Area273 Ų
    Heavy Atom Count37
    Formal Charge0
    Complexity680
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    Post Enquiry
    POST ENQUIRY