ChemSpider 2D Image | 2-{[1-(2,5-Dimethoxyphenyl)-5,5-dioxido-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-2-yl]sulfanyl}-N,N-dimethylacetamide | C17H23N3O5S2

2-{[1-(2,5-Dimethoxyphenyl)-5,5-dioxido-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-2-yl]sulfanyl}-N,N-dimethylacetamide

  • Molecular FormulaC17H23N3O5S2
  • Average mass413.512 Da
  • Monoisotopic mass413.107910 Da
  • ChemSpider ID21480210

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-{[1-(2,5-Dimethoxyphenyl)-5,5-dioxido-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-2-yl]sulfanyl}-N,N-dimethylacetamid [German] [ACD/IUPAC Name]
2-{[1-(2,5-Dimethoxyphenyl)-5,5-dioxido-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-2-yl]sulfanyl}-N,N-dimethylacetamide [ACD/IUPAC Name]
2-{[1-(2,5-Diméthoxyphényl)-5,5-dioxydo-3a,4,6,6a-tétrahydro-1H-thiéno[3,4-d]imidazol-2-yl]sulfanyl}-N,N-diméthylacétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[1-(2,5-dimethoxyphenyl)-3a,4,6,6a-tetrahydro-5,5-dioxido-1H-thieno[3,4-d]imidazol-2-yl]thio]-N,N-dimethyl- [ACD/Index Name]
2-[[3-(2,5-dimethoxyphenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-2-yl]sulfanyl]-N,N-dimethylacetamide
2-[1-(2,5-Dimethoxy-phenyl)-5,5-dioxo-1,3a,4,5,6,6a-hexahydro-5λ*6*-thieno[3,4-d]imidazol-2-ylsulfanyl]-N,N-dimethyl-acetamide
903201-34-3 [RN]
AGN-PC-01KGCI
AKOS002325442
AKOS016334233
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 655.4±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 96.5±3.0 kJ/mol
    Flash Point: 350.2±34.3 °C
    Index of Refraction: 1.646
    Molar Refractivity: 104.7±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: -0.12
    ACD/LogD (pH 5.5): 0.63
    ACD/BCF (pH 5.5): 1.77
    ACD/KOC (pH 5.5): 51.93
    ACD/LogD (pH 7.4): 0.65
    ACD/BCF (pH 7.4): 1.83
    ACD/KOC (pH 7.4): 53.59
    Polar Surface Area: 122 Å2
    Polarizability: 41.5±0.5 10-24cm3
    Surface Tension: 53.1±7.0 dyne/cm
    Molar Volume: 288.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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