ChemSpider 2D Image | 5-({[2-(2,2-Dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydro-7-isoquinolinyl]oxy}methyl)-N-propyl-2-furamide | C29H33FN2O4

5-({[2-(2,2-Dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydro-7-isoquinolinyl]oxy}methyl)-N-propyl-2-furamide

  • Molecular FormulaC29H33FN2O4
  • Average mass492.582 Da
  • Monoisotopic mass492.242432 Da
  • ChemSpider ID22710126

More details:

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

2-Furancarboxamide, 5-[[[2-(2,2-dimethyl-1-oxopropyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydro-7-isoquinolinyl]oxy]methyl]-N-propyl- [ACD/Index Name]
5-({[2-(2,2-Diméthylpropanoyl)-1-(3-fluorophényl)-1,2,3,4-tétrahydro-7-isoquinoléinyl]oxy}méthyl)-N-propyl-2-furamide [French] [ACD/IUPAC Name]
5-({[2-(2,2-Dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydro-7-isoquinolinyl]oxy}methyl)-N-propyl-2-furamide [ACD/IUPAC Name]
5-({[2-(2,2-Dimethylpropanoyl)-1-(3-fluorphenyl)-1,2,3,4-tetrahydro-7-isochinolinyl]oxy}methyl)-N-propyl-2-furamid [German] [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: 651.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.0±3.0 kJ/mol
Flash Point: 347.7±31.5 °C
Index of Refraction: 1.564
Molar Refractivity: 135.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.88
ACD/LogD (pH 5.5): 4.77
ACD/BCF (pH 5.5): 2468.82
ACD/KOC (pH 5.5): 9331.24
ACD/LogD (pH 7.4): 4.77
ACD/BCF (pH 7.4): 2468.82
ACD/KOC (pH 7.4): 9331.24
Polar Surface Area: 72 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 44.7±3.0 dyne/cm
Molar Volume: 417.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement