ChemSpider 2D Image | N-(3-Cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanamide | C29H28N4O3S

N-(3-Cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanamide

  • Molecular FormulaC29H28N4O3S
  • Average mass512.623 Da
  • Monoisotopic mass512.188232 Da
  • ChemSpider ID2724185

More details:

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

2H-Isoindole-2-acetamide, N-(3-cyano-4,5,6,7-tetrahydro-5,5,7,7-tetramethylthieno[2,3-c]pyridin-2-yl)-1,3-dihydro-1,3-dioxo-α-(phenylmethyl)- [ACD/Index Name]
N-(3-Cyan-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanamid [German] [ACD/IUPAC Name]
N-(3-Cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanamide [ACD/IUPAC Name]
N-(3-Cyano-5,5,7,7-tétraméthyl-4,5,6,7-tétrahydrothiéno[2,3-c]pyridin-2-yl)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-phénylpropanamide [French] [ACD/IUPAC Name]
381172-10-7 [RN]
N-(3-cyano-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide

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

EU-0009427 [DBID]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 725.6±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.4 mmHg at 25°C
    Enthalpy of Vaporization: 106.0±3.0 kJ/mol
    Flash Point: 392.7±32.9 °C
    Index of Refraction: 1.673
    Molar Refractivity: 141.9±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 2
    ACD/LogP: 5.40
    ACD/LogD (pH 5.5): 2.37
    ACD/BCF (pH 5.5): 10.33
    ACD/KOC (pH 5.5): 40.38
    ACD/LogD (pH 7.4): 4.08
    ACD/BCF (pH 7.4): 523.44
    ACD/KOC (pH 7.4): 2046.01
    Polar Surface Area: 131 Å2
    Polarizability: 56.2±0.5 10-24cm3
    Surface Tension: 68.6±5.0 dyne/cm
    Molar Volume: 378.4±5.0 cm3

    Click to predict properties on the Chemicalize site


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