ChemSpider 2D Image | 6-(2-Ethyl-6-{4-[4-(2-methyl-2-propanyl)benzyl]-1-piperidinyl}-4-pyrimidinyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane | C32H48N4

6-(2-Ethyl-6-{4-[4-(2-methyl-2-propanyl)benzyl]-1-piperidinyl}-4-pyrimidinyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane

  • Molecular FormulaC32H48N4
  • Average mass488.750 Da
  • Monoisotopic mass488.387909 Da
  • ChemSpider ID121809888

More details:

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

6-(2-Ethyl-6-{4-[4-(2-methyl-2-propanyl)benzyl]-1-piperidinyl}-4-pyrimidinyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan [German] [ACD/IUPAC Name]
6-(2-Ethyl-6-{4-[4-(2-methyl-2-propanyl)benzyl]-1-piperidinyl}-4-pyrimidinyl)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane [ACD/IUPAC Name]
6-(2-Éthyl-6-{4-[4-(2-méthyl-2-propanyl)benzyl]-1-pipéridinyl}-4-pyrimidinyl)-1,3,3-triméthyl-6-azabicyclo[3.2.1]octane [French] [ACD/IUPAC Name]
6-Azabicyclo[3.2.1]octane, 6-[6-[4-[[4-(1,1-dimethylethyl)phenyl]methyl]-1-piperidinyl]-2-ethyl-4-pyrimidinyl]-1,3,3-trimethyl- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 604.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.9±3.0 kJ/mol
Flash Point: 319.5±28.7 °C
Index of Refraction: 1.556
Molar Refractivity: 150.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 7.68
ACD/LogD (pH 5.5): 5.10
ACD/BCF (pH 5.5): 1107.00
ACD/KOC (pH 5.5): 1023.51
ACD/LogD (pH 7.4): 5.10
ACD/BCF (pH 7.4): 1120.85
ACD/KOC (pH 7.4): 1036.32
Polar Surface Area: 32 Å2
Polarizability: 59.6±0.5 10-24cm3
Surface Tension: 42.4±3.0 dyne/cm
Molar Volume: 467.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement