ChemSpider 2D Image | 5-Cyano-6-({2-[(4-ethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-N-(2-methoxyphenyl)-2-methyl-4-phenyl-1,4-dihydro-3-pyridinecarboxamide | C31H30N4O4S

5-Cyano-6-({2-[(4-ethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-N-(2-methoxyphenyl)-2-methyl-4-phenyl-1,4-dihydro-3-pyridinecarboxamide

  • Molecular FormulaC31H30N4O4S
  • Average mass554.659 Da
  • Monoisotopic mass554.198792 Da
  • ChemSpider ID4100158

More details:

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

3-Pyridinecarboxamide, 5-cyano-6-[[2-[(4-ethoxyphenyl)amino]-2-oxoethyl]thio]-1,4-dihydro-N-(2-methoxyphenyl)-2-methyl-4-phenyl- [ACD/Index Name]
5-Cyan-6-({2-[(4-ethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-N-(2-methoxyphenyl)-2-methyl-4-phenyl-1,4-dihydro-3-pyridincarboxamid [German] [ACD/IUPAC Name]
5-Cyano-6-({2-[(4-ethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-N-(2-methoxyphenyl)-2-methyl-4-phenyl-1,4-dihydro-3-pyridinecarboxamide [ACD/IUPAC Name]
5-Cyano-6-({2-[(4-éthoxyphényl)amino]-2-oxoéthyl}sulfanyl)-N-(2-méthoxyphényl)-2-méthyl-4-phényl-1,4-dihydro-3-pyridinecarboxamide [French] [ACD/IUPAC Name]
477296-10-9 [RN]
5-cyano-6-((2-((4-ethoxyphenyl)amino)-2-oxoethyl)thio)-N-(2-methoxyphenyl)-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
5-cyano-6-({2-[(4-ethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-N-(2-methoxyphenyl)-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
5-Cyano-6-[(4-ethoxy-phenylcarbamoyl)-methylsulfanyl]-2-methyl-4-phenyl-1,4-dihydro-pyridine-3-carboxylic acid (2-methoxy-phenyl)-amide
5-CYANO-6-[2-(4-ETHOXYANILINO)-2-OXOETHYL]SULFANYL-N-(2-METHOXYPHENYL)-2-METHYL-4-PHENYL-1,4-DIHYDROPYRIDINE-3-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: 803.3±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.8 mmHg at 25°C
    Enthalpy of Vaporization: 116.8±3.0 kJ/mol
    Flash Point: 439.6±34.3 °C
    Index of Refraction: 1.658
    Molar Refractivity: 155.8±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 3
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 2
    ACD/LogP: 5.58
    ACD/LogD (pH 5.5): 5.33
    ACD/BCF (pH 5.5): 6658.98
    ACD/KOC (pH 5.5): 18983.18
    ACD/LogD (pH 7.4): 5.33
    ACD/BCF (pH 7.4): 6659.89
    ACD/KOC (pH 7.4): 18985.79
    Polar Surface Area: 138 Å2
    Polarizability: 61.8±0.5 10-24cm3
    Surface Tension: 63.7±5.0 dyne/cm
    Molar Volume: 423.0±5.0 cm3

    Click to predict properties on the Chemicalize site


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