ChemSpider 2D Image | 2'-(2-Methoxyethyl)-1'-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide | C23H30N4O3S

2'-(2-Methoxyethyl)-1'-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide

  • Molecular FormulaC23H30N4O3S
  • Average mass442.574 Da
  • Monoisotopic mass442.203857 Da
  • ChemSpider ID27324591

More details:

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

2'-(2-Methoxyethyl)-1'-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamid [German] [ACD/IUPAC Name]
2'-(2-Methoxyethyl)-1'-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide [ACD/IUPAC Name]
2'-(2-Méthoxyéthyl)-1'-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide [French] [ACD/IUPAC Name]
Spiro[cyclohexane-1,3'(2'H)-isoquinoline]-4'-carboxamide, 1',4'-dihydro-2'-(2-methoxyethyl)-1'-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)- [ACD/Index Name]
1246036-38-3 [RN]
2-(2-methoxyethyl)-1-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)spiro[4H-isoquinoline-3,1'-cyclohexane]-4-carboxamide
2'-(2-methoxyethyl)-1'-oxo-N-[(2E)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 600.7±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 89.4±3.0 kJ/mol
    Flash Point: 317.1±34.3 °C
    Index of Refraction: 1.658
    Molar Refractivity: 122.5±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 2.54
    ACD/LogD (pH 5.5): 3.17
    ACD/BCF (pH 5.5): 151.51
    ACD/KOC (pH 5.5): 1265.81
    ACD/LogD (pH 7.4): 3.17
    ACD/BCF (pH 7.4): 151.51
    ACD/KOC (pH 7.4): 1265.81
    Polar Surface Area: 109 Å2
    Polarizability: 48.6±0.5 10-24cm3
    Surface Tension: 52.8±7.0 dyne/cm
    Molar Volume: 332.6±7.0 cm3

    Click to predict properties on the Chemicalize site


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