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 > NSC661193,AIDS142846,AIDS-142846,NCI60_021325,2-(2-Chloro-4-(4-chlorob

  • NSC661193,AIDS142846,AIDS-142846,NCI60_021325,2-(2-Chloro-4-(4-chlorob
  • 发布时间：2004-10-25 来源：本站整理
  • [Synonyms]
    NSC661193
    AIDS142846
    AIDS-142846
    NCI60_021325
    2-(2-Chloro-4-(4-chlorobenzoyl)phenoxy)-N-(2-(dimethylamino)ethyl)-2-methylpropanamide
    Propanamide, 2-[4-[[4-chlorophenyl]carbonyl]-2-chlorophenoxy]-2-methyl- N-[2-(dimethylamino)ethyl]-

    [Structure]

    [ Properties Computed from Structure]
    Molecular Weight423.33286 [g/mol]
    Molecular FormulaC21H24Cl2N2O3
    XLogP4.4
    H-Bond Donor1
    H-Bond Acceptor4
    Rotatable Bond Count8
    Tautomer Count2
    Exact Mass422.116398
    MonoIsotopic Mass422.116398
    Topological Polar Surface Area58.6
    Heavy Atom Count28
    Formal Charge0
    Complexity534
    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: 2-[2-chloro-4-(4-chlorobenzoyl)phenoxy]-N-(2-dimethylaminoethyl)-2-
    methylpropanamide
    Canonical SMILES: CC(C)(C(=O)NCCN(C)C)OC1=C(C=C(C=C1)C(=O)C2=CC=C(C=C2)Cl)Cl
    InChI: InChI=1/C21H24Cl2N2O3/c1-21(2,
    20(27)24-11-12-25(3)4)28-18-10-7-15(13-17(18)23)19(26)14-5-8-16(22)9-6-
    14/h5-10,13H,11-12H2,1-4H3,(H,24,27)/f/h24H

    ChemDrug版权识别码:80050185370810534161
赞助商链接

健康论文数据库
推荐专业资料
赞助商链接