ChemSpider 2D Image | N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-1,2-dihydro-4-isoquinolinecarboxamide | C30H32N2O7

N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-1,2-dihydro-4-isoquinolinecarboxamide

  • Molecular FormulaC30H32N2O7
  • Average mass532.584 Da
  • Monoisotopic mass532.220947 Da
  • ChemSpider ID4395148

More details:

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

4-Isoquinolinecarboxamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-ethoxyphenyl)-1,2-dihydro-6,7-dimethoxy-1-oxo- [ACD/Index Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-1,2-dihydro-4-isochinolincarboxamid [German] [ACD/IUPAC Name]
N-[2-(3,4-Diméthoxyphényl)éthyl]-2-(4-éthoxyphényl)-6,7-diméthoxy-1-oxo-1,2-dihydro-4-isoquinoléinecarboxamide [French] [ACD/IUPAC Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-(4-ethoxyphenyl)-6,7-dimethoxy-1-oxo-1,2-dihydro-4-isoquinolinecarboxamide [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: 770.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.1±3.0 kJ/mol
Flash Point: 419.5±32.9 °C
Index of Refraction: 1.590
Molar Refractivity: 146.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 4.19
ACD/LogD (pH 5.5): 3.13
ACD/BCF (pH 5.5): 141.86
ACD/KOC (pH 5.5): 1207.57
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 141.86
ACD/KOC (pH 7.4): 1207.57
Polar Surface Area: 96 Å2
Polarizability: 57.9±0.5 10-24cm3
Surface Tension: 48.4±3.0 dyne/cm
Molar Volume: 433.1±3.0 cm3

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