ChemSpider 2D Image | 2-{[2-(2,2-Dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydro-7-isoquinolinyl]oxy}-N-(2-furylmethyl)-N-methylbutanamide | C30H35FN2O4

2-{[2-(2,2-Dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydro-7-isoquinolinyl]oxy}-N-(2-furylmethyl)-N-methylbutanamide

  • Molecular FormulaC30H35FN2O4
  • Average mass506.608 Da
  • Monoisotopic mass506.258087 Da
  • ChemSpider ID22709434

More details:

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

2-{[2-(2,2-Diméthylpropanoyl)-1-(3-fluorophényl)-1,2,3,4-tétrahydro-7-isoquinoléinyl]oxy}-N-(2-furylméthyl)-N-méthylbutanamide [French] [ACD/IUPAC Name]
2-{[2-(2,2-Dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydro-7-isoquinolinyl]oxy}-N-(2-furylmethyl)-N-methylbutanamide [ACD/IUPAC Name]
2-{[2-(2,2-Dimethylpropanoyl)-1-(3-fluorphenyl)-1,2,3,4-tetrahydro-7-isochinolinyl]oxy}-N-(2-furylmethyl)-N-methylbutanamid [German] [ACD/IUPAC Name]
Butanamide, 2-[[2-(2,2-dimethyl-1-oxopropyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydro-7-isoquinolinyl]oxy]-N-(2-furanylmethyl)-N-methyl- [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: 651.7±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: 347.9±31.5 °C
Index of Refraction: 1.562
Molar Refractivity: 139.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.61
ACD/LogD (pH 5.5): 5.09
ACD/BCF (pH 5.5): 4358.00
ACD/KOC (pH 5.5): 14015.06
ACD/LogD (pH 7.4): 5.09
ACD/BCF (pH 7.4): 4358.00
ACD/KOC (pH 7.4): 14015.06
Polar Surface Area: 63 Å2
Polarizability: 55.4±0.5 10-24cm3
Surface Tension: 45.0±3.0 dyne/cm
Molar Volume: 431.3±3.0 cm3

Click to predict properties on the Chemicalize site


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