ChemSpider 2D Image | N-Cyclohexyl-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methyl-2-thienyl)methyl]amino}-2-oxoethyl)-3-phenylacrylamide | C33H40N2O4S

N-Cyclohexyl-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methyl-2-thienyl)methyl]amino}-2-oxoethyl)-3-phenylacrylamide

  • Molecular FormulaC33H40N2O4S
  • Average mass560.747 Da
  • Monoisotopic mass560.270874 Da
  • ChemSpider ID3737479

More details:

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

2-Propenamide, N-cyclohexyl-N-[2-[[2-(3,4-dimethoxyphenyl)ethyl][(5-methyl-2-thienyl)methyl]amino]-2-oxoethyl]-3-phenyl- [ACD/Index Name]
N-Cyclohexyl-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methyl-2-thienyl)methyl]amino}-2-oxoethyl)-3-phenylacrylamid [German] [ACD/IUPAC Name]
N-Cyclohexyl-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(5-methyl-2-thienyl)methyl]amino}-2-oxoethyl)-3-phenylacrylamide [ACD/IUPAC Name]
N-Cyclohexyl-N-(2-{[2-(3,4-diméthoxyphényl)éthyl][(5-méthyl-2-thiényl)méthyl]amino}-2-oxoéthyl)-3-phénylacrylamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 746.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.9±3.0 kJ/mol
Flash Point: 405.4±32.9 °C
Index of Refraction: 1.611
Molar Refractivity: 162.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 6.75
ACD/LogD (pH 5.5): 5.91
ACD/BCF (pH 5.5): 18374.66
ACD/KOC (pH 5.5): 39256.81
ACD/LogD (pH 7.4): 5.91
ACD/BCF (pH 7.4): 18374.66
ACD/KOC (pH 7.4): 39256.81
Polar Surface Area: 87 Å2
Polarizability: 64.4±0.5 10-24cm3
Surface Tension: 54.8±5.0 dyne/cm
Molar Volume: 467.5±5.0 cm3

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