ChemSpider 2D Image | 5-[[2,3,5,6-tetradeuterio-4-[2-(2-pyridylamino)ethoxy]phenyl]methyl]thiazolidine-2,4-dione | C17H13D4N3O3S

5-[[2,3,5,6-tetradeuterio-4-[2-(2-pyridylamino)ethoxy]phenyl]methyl]thiazolidine-2,4-dione

  • Molecular FormulaC17H13D4N3O3S
  • Average mass347.425 Da
  • Monoisotopic mass347.124176 Da
  • ChemSpider ID28569846

  • Non-standard isotope - Non-standard isotope

More details:

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

1215407-67-2 [RN]
2,4-Thiazolidinedione, 5-[[4-[2-(2-pyridinylamino)ethoxy]phenyl-2,3,5,6-d4]methyl]- [ACD/Index Name]
257892-31-2 [RN]
5-({4-[2-(2-Pyridinylamino)ethoxy](2H4)phenyl}methyl)-1,3-thiazolidin-2,4-dion [German] [ACD/IUPAC Name]
5-({4-[2-(2-Pyridinylamino)ethoxy](2H4)phenyl}methyl)-1,3-thiazolidine-2,4-dione [ACD/IUPAC Name]
5-({4-[2-(2-Pyridinylamino)éthoxy](2H4)phényl}méthyl)-1,3-thiazolidine-2,4-dione [French] [ACD/IUPAC Name]
5-[[2,3,5,6-tetradeuterio-4-[2-(pyridin-2-ylamino)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
MFCD11977897
N-DESMETHYL ROSIGLITAZONE-D4

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 612.9±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 91.0±3.0 kJ/mol
    Flash Point: 324.5±27.3 °C
    Index of Refraction: 1.659
    Molar Refractivity: 93.4±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 2.22
    ACD/LogD (pH 5.5): 1.77
    ACD/BCF (pH 5.5): 8.24
    ACD/KOC (pH 5.5): 91.83
    ACD/LogD (pH 7.4): 1.52
    ACD/BCF (pH 7.4): 4.69
    ACD/KOC (pH 7.4): 52.28
    Polar Surface Area: 106 Å2
    Polarizability: 37.0±0.5 10-24cm3
    Surface Tension: 65.4±3.0 dyne/cm
    Molar Volume: 253.1±3.0 cm3

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