登录 免费注册 发布信息
咨询热线：028-85335741
药品资讯网--新药研发行业门户!
您现在的位置：药品资讯网 > 专业资料首页 > 健康论文数据库 > NSC125256,BTB 13090,ZINC01714366,75140-04-4, 4-[(3-hydroxyphenyl)amino

  • NSC125256,BTB 13090,ZINC01714366,75140-04-4, 4-[(3-hydroxyphenyl)amino
  • 发布时间：2004-10-25 来源：本站整理
  • [Synonyms]
    NSC125256
    BTB 13090
    ZINC01714366
    75140-04-4

    [Structure]
    NSC125256,BTB 13090,ZINC01714366,75140-04-4, 4-[(3-hydroxyphenyl)amino

    [ Properties Computed from Structure]
    Molecular Weight265.26344 [g/mol]
    Molecular FormulaC16H11NO3
    XLogP2.6
    H-Bond Donor2
    H-Bond Acceptor4
    Rotatable Bond Count2
    Tautomer Count17
    Exact Mass265.073893
    MonoIsotopic Mass265.073893
    Topological Polar Surface Area66.4
    Heavy Atom Count20
    Formal Charge0
    Complexity443
    Isotope Atom Count0
    Defined Atom StereoCenter Count0
    Undefined Atom StereoCenter Count0
    Defined Bond StereoCenter Count0
    Undefined Bond StereoCenter Count0
    Covalently-Bonded Unit Count1

    [ Descriptors Computed from Structure]
    IUPAC Name: 4-[(3-hydroxyphenyl)amino]naphthalene-1,2-dione
    Canonical SMILES: C1=CC=C2C(=C1)C(=CC(=O)C2=O)NC3=CC(=CC=C3)O
    InChI: InChI=1/C16H11NO3/c18-11-5-3-4-10(8-11)17-14-9-15(19)16(20)13-7-2-1-6-12
    (13)14/h1-9,17-18H

赞助商链接

健康论文数据库
推荐专业资料
赞助商链接