ChemSpider 2D Image | 3-(3,4-Dimethoxyphenyl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydro-4-isoquinolinecarboxamide | C33H41N3O6

3-(3,4-Dimethoxyphenyl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydro-4-isoquinolinecarboxamide

  • Molecular FormulaC33H41N3O6
  • Average mass575.695 Da
  • Monoisotopic mass575.299561 Da
  • ChemSpider ID22494576

More details:

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

3-(3,4-Dimethoxyphenyl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydro-4-isochinolincarboxamid [German] [ACD/IUPAC Name]
3-(3,4-Diméthoxyphényl)-N-{3-[éthyl(3-méthylphényl)amino]propyl}-6,7-diméthoxy-2-méthyl-1-oxo-1,2,3,4-tétrahydro-4-isoquinoléinecarboxamide [French] [ACD/IUPAC Name]
3-(3,4-Dimethoxyphenyl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydro-4-isoquinolinecarboxamide [ACD/IUPAC Name]
4-Isoquinolinecarboxamide, 3-(3,4-dimethoxyphenyl)-N-[3-[ethyl(3-methylphenyl)amino]propyl]-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-oxo- [ACD/Index 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: 764.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.3±3.0 kJ/mol
Flash Point: 416.0±32.9 °C
Index of Refraction: 1.578
Molar Refractivity: 163.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 5.06
ACD/LogD (pH 5.5): 3.38
ACD/BCF (pH 5.5): 145.48
ACD/KOC (pH 5.5): 753.83
ACD/LogD (pH 7.4): 4.11
ACD/BCF (pH 7.4): 768.55
ACD/KOC (pH 7.4): 3982.26
Polar Surface Area: 90 Å2
Polarizability: 64.8±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 492.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement