ChemSpider 2D Image | N-[2-(3,4-Dimethoxyphenyl)ethyl]-N-(2-furylmethyl)-N~2~-{[4-(methylsulfanyl)phenyl]carbamoyl}-N~2~-[2-(4-morpholinyl)ethyl]glycinamide | C31H40N4O6S

N-[2-(3,4-Dimethoxyphenyl)ethyl]-N-(2-furylmethyl)-N2-{[4-(methylsulfanyl)phenyl]carbamoyl}-N2-[2-(4-morpholinyl)ethyl]glycinamide

  • Molecular FormulaC31H40N4O6S
  • Average mass596.737 Da
  • Monoisotopic mass596.266846 Da
  • ChemSpider ID3105421

More details:






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

Acetamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-N-(2-furanylmethyl)-2-[[[[4-(methylthio)phenyl]amino]carbonyl][2-(4-morpholinyl)ethyl]amino]- [ACD/Index Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-N-(2-furylmethyl)-N2-{[4-(methylsulfanyl)phenyl]carbamoyl}-N2-[2-(4-morpholinyl)ethyl]glycinamid [German] [ACD/IUPAC Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-N-(2-furylmethyl)-N2-{[4-(methylsulfanyl)phenyl]carbamoyl}-N2-[2-(4-morpholinyl)ethyl]glycinamide [ACD/IUPAC Name]
N-[2-(3,4-Diméthoxyphényl)éthyl]-N-(2-furylméthyl)-N2-{[4-(méthylsulfanyl)phényl]carbamoyl}-N2-[2-(4-morpholinyl)éthyl]glycinamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 791.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 115.1±3.0 kJ/mol
Flash Point: 432.5±32.9 °C
Index of Refraction: 1.624
Molar Refractivity: 164.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 2.88
ACD/BCF (pH 5.5): 56.08
ACD/KOC (pH 5.5): 352.11
ACD/LogD (pH 7.4): 3.71
ACD/BCF (pH 7.4): 382.99
ACD/KOC (pH 7.4): 2404.71
Polar Surface Area: 122 Å2
Polarizability: 65.3±0.5 10-24cm3
Surface Tension: 60.8±5.0 dyne/cm
Molar Volume: 466.9±5.0 cm3

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