ChemSpider 2D Image | Rosiglitazone-d3 | C18H16D3N3O3S

Rosiglitazone-d3

  • Molecular FormulaC18H16D3N3O3S
  • Average mass360.445 Da
  • Monoisotopic mass360.133545 Da
  • ChemSpider ID23937137

  • Non-standard isotope - Non-standard isotope

More details:

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

1132641-22-5 [RN]
2,4-Thiazolidinedione, 5-[[4-[2-(methyl-d3-2-pyridinylamino)ethoxy]phenyl]methyl]- [ACD/Index Name]
5-(4-{2-[(2H3)Methyl(2-pyridinyl)amino]ethoxy}benzyl)-1,3-thiazolidin-2,4-dion [German] [ACD/IUPAC Name]
5-(4-{2-[(2H3)Methyl(2-pyridinyl)amino]ethoxy}benzyl)-1,3-thiazolidine-2,4-dione [ACD/IUPAC Name]
5-(4-{2-[(2H3)Méthyl(2-pyridinyl)amino]éthoxy}benzyl)-1,3-thiazolidine-2,4-dione [French] [ACD/IUPAC Name]
Rosiglitazone-d3
5-[[4-[2-(methyl-d3-2-pyridinylamino)ethoxy]phenyl]methyl]-2,4-thiazolidinedione
5-[[4-[2-[pyridin-2-yl(trideuteriomethyl)amino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
Rosiglitazone-d3

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

    Density: 1.3±0.0 g/cm3
    Boiling Point: 585.0±0.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.0 mmHg at 25°C
    Enthalpy of Vaporization: 87.4±0.0 kJ/mol
    Flash Point: 307.6±0.0 °C
    Index of Refraction: 1.642
    Molar Refractivity: 98.1±0.0 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 3.02
    ACD/LogD (pH 5.5): 1.94
    ACD/BCF (pH 5.5): 9.66
    ACD/KOC (pH 5.5): 86.90
    ACD/LogD (pH 7.4): 1.93
    ACD/BCF (pH 7.4): 9.40
    ACD/KOC (pH 7.4): 84.54
    Polar Surface Area: 97 Å2
    Polarizability: 38.9±0.0 10-24cm3
    Surface Tension: 60.6±0.0 dyne/cm
    Molar Volume: 271.6±0.0 cm3

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