ChemSpider 2D Image | N-[(1Z)-1-(1-Ethyl-1H-indol-3-yl)-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxo-1-propen-2-yl]-3,4,5-trimethoxybenzamide | C33H34N4O5

N-[(1Z)-1-(1-Ethyl-1H-indol-3-yl)-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxo-1-propen-2-yl]-3,4,5-trimethoxybenzamide

  • Molecular FormulaC33H34N4O5
  • Average mass566.647 Da
  • Monoisotopic mass566.252930 Da
  • ChemSpider ID17540068

  • Double-bond stereo - Double-bond stereo

More details:

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

Benzamide, N-[(Z)-2-(1-ethyl-1H-indol-3-yl)-1-[[[2-(1H-indol-3-yl)ethyl]amino]carbonyl]ethenyl]-3,4,5-trimethoxy- [ACD/Index Name]
N-[(1Z)-1-(1-Ethyl-1H-indol-3-yl)-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxo-1-propen-2-yl]-3,4,5-trimethoxybenzamid [German] [ACD/IUPAC Name]
N-[(1Z)-1-(1-Ethyl-1H-indol-3-yl)-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxo-1-propen-2-yl]-3,4,5-trimethoxybenzamide [ACD/IUPAC Name]
N-[(1Z)-1-(1-Éthyl-1H-indol-3-yl)-3-{[2-(1H-indol-3-yl)éthyl]amino}-3-oxo-1-propén-2-yl]-3,4,5-triméthoxybenzamide [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: 907.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 131.9±3.0 kJ/mol
Flash Point: 502.4±34.3 °C
Index of Refraction: 1.620
Molar Refractivity: 160.1±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 4.74
ACD/LogD (pH 5.5): 4.48
ACD/BCF (pH 5.5): 1505.42
ACD/KOC (pH 5.5): 6548.81
ACD/LogD (pH 7.4): 4.48
ACD/BCF (pH 7.4): 1502.64
ACD/KOC (pH 7.4): 6536.72
Polar Surface Area: 107 Å2
Polarizability: 63.5±0.5 10-24cm3
Surface Tension: 46.0±7.0 dyne/cm
Molar Volume: 455.8±7.0 cm3

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