ChemSpider 2D Image | (2E)-N-Cyclopropyl-N-(2-{(3,4-dimethoxybenzyl)[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-3-(4-nitrophenyl)acrylamide | C33H34N4O6

(2E)-N-Cyclopropyl-N-(2-{(3,4-dimethoxybenzyl)[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-3-(4-nitrophenyl)acrylamide

  • Molecular FormulaC33H34N4O6
  • Average mass582.646 Da
  • Monoisotopic mass582.247864 Da
  • ChemSpider ID22804499

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-N-Cyclopropyl-N-(2-{(3,4-dimethoxybenzyl)[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-3-(4-nitrophenyl)acrylamid [German] [ACD/IUPAC Name]
(2E)-N-Cyclopropyl-N-(2-{(3,4-dimethoxybenzyl)[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-3-(4-nitrophenyl)acrylamide [ACD/IUPAC Name]
(2E)-N-Cyclopropyl-N-(2-{(3,4-diméthoxybenzyl)[2-(1H-indol-3-yl)éthyl]amino}-2-oxoéthyl)-3-(4-nitrophényl)acrylamide [French] [ACD/IUPAC Name]
2-Propenamide, N-cyclopropyl-N-[2-[[(3,4-dimethoxyphenyl)methyl][2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]-3-(4-nitrophenyl)-, (2E)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 823.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 119.6±3.0 kJ/mol
Flash Point: 451.6±34.3 °C
Index of Refraction: 1.671
Molar Refractivity: 163.2±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 4.62
ACD/LogD (pH 5.5): 4.34
ACD/BCF (pH 5.5): 1180.71
ACD/KOC (pH 5.5): 5503.50
ACD/LogD (pH 7.4): 4.34
ACD/BCF (pH 7.4): 1180.71
ACD/KOC (pH 7.4): 5503.50
Polar Surface Area: 121 Å2
Polarizability: 64.7±0.5 10-24cm3
Surface Tension: 67.6±5.0 dyne/cm
Molar Volume: 436.6±5.0 cm3

Click to predict properties on the Chemicalize site


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