ChemSpider 2D Image | N-[2-(Cyclohexylamino)-1-(4-nitrophenyl)-2-oxoethyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methoxy-2-nitrobenzamide | C32H36N4O9

N-[2-(Cyclohexylamino)-1-(4-nitrophenyl)-2-oxoethyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methoxy-2-nitrobenzamide

  • Molecular FormulaC32H36N4O9
  • Average mass620.650 Da
  • Monoisotopic mass620.248230 Da
  • ChemSpider ID58909919

More details:

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

Benzeneacetamide, N-cyclohexyl-α-[[2-(3,4-dimethoxyphenyl)ethyl](5-methoxy-2-nitrobenzoyl)amino]-4-nitro- [ACD/Index Name]
N-[2-(Cyclohexylamino)-1-(4-nitrophenyl)-2-oxoethyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methoxy-2-nitrobenzamid [German] [ACD/IUPAC Name]
N-[2-(Cyclohexylamino)-1-(4-nitrophenyl)-2-oxoethyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methoxy-2-nitrobenzamide [ACD/IUPAC Name]
N-[2-(Cyclohexylamino)-1-(4-nitrophényl)-2-oxoéthyl]-N-[2-(3,4-diméthoxyphényl)éthyl]-5-méthoxy-2-nitrobenzamide [French] [ACD/IUPAC 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: 853.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 124.0±3.0 kJ/mol
Flash Point: 470.1±34.3 °C
Index of Refraction: 1.623
Molar Refractivity: 164.0±0.4 cm3
#H bond acceptors: 13
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: 5.17
ACD/LogD (pH 5.5): 4.62
ACD/BCF (pH 5.5): 1916.44
ACD/KOC (pH 5.5): 7784.08
ACD/LogD (pH 7.4): 4.62
ACD/BCF (pH 7.4): 1916.44
ACD/KOC (pH 7.4): 7784.08
Polar Surface Area: 169 Å2
Polarizability: 65.0±0.5 10-24cm3
Surface Tension: 63.7±5.0 dyne/cm
Molar Volume: 464.8±5.0 cm3

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