ChemSpider 2D Image | N-[2-(3,4-Dimethoxyphenyl)ethyl]-N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide | C29H30N4O8

N-[2-(3,4-Dimethoxyphenyl)ethyl]-N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide

  • Molecular FormulaC29H30N4O8
  • Average mass562.570 Da
  • Monoisotopic mass562.206360 Da
  • ChemSpider ID21543282

More details:

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

Benzamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl]-3-nitro- [ACD/Index Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamid [German] [ACD/IUPAC Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide [ACD/IUPAC Name]
N-[2-(3,4-Diméthoxyphényl)éthyl]-N-{2-[3-(3,4-diméthoxyphényl)-1,2,4-oxadiazol-5-yl]éthyl}-3-nitrobenzamide [French] [ACD/IUPAC Name]
N1-(3,4-dimethoxyphenethyl)-N1-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 749.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.2±3.0 kJ/mol
Flash Point: 406.8±35.7 °C
Index of Refraction: 1.591
Molar Refractivity: 149.2±0.3 cm3
#H bond acceptors: 12
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 4.89
ACD/LogD (pH 5.5): 3.98
ACD/BCF (pH 5.5): 623.78
ACD/KOC (pH 5.5): 3485.65
ACD/LogD (pH 7.4): 3.98
ACD/BCF (pH 7.4): 623.78
ACD/KOC (pH 7.4): 3485.66
Polar Surface Area: 142 Å2
Polarizability: 59.2±0.5 10-24cm3
Surface Tension: 50.9±3.0 dyne/cm
Molar Volume: 441.5±3.0 cm3

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