ChemSpider 2D Image | N-Cyclohexyl-2-(4-ethoxyphenyl)-N-methyl-6-{4-[4-(2-methyl-2-propanyl)benzyl]-1-piperidinyl}-4-pyrimidinamine | C35H48N4O

N-Cyclohexyl-2-(4-ethoxyphenyl)-N-methyl-6-{4-[4-(2-methyl-2-propanyl)benzyl]-1-piperidinyl}-4-pyrimidinamine

  • Molecular FormulaC35H48N4O
  • Average mass540.782 Da
  • Monoisotopic mass540.382813 Da
  • ChemSpider ID121912684

More details:

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

4-Pyrimidinamine, N-cyclohexyl-6-[4-[[4-(1,1-dimethylethyl)phenyl]methyl]-1-piperidinyl]-2-(4-ethoxyphenyl)-N-methyl- [ACD/Index Name]
N-Cyclohexyl-2-(4-ethoxyphenyl)-N-methyl-6-{4-[4-(2-methyl-2-propanyl)benzyl]-1-piperidinyl}-4-pyrimidinamin [German] [ACD/IUPAC Name]
N-Cyclohexyl-2-(4-ethoxyphenyl)-N-methyl-6-{4-[4-(2-methyl-2-propanyl)benzyl]-1-piperidinyl}-4-pyrimidinamine [ACD/IUPAC Name]
N-Cyclohexyl-2-(4-éthoxyphényl)-N-méthyl-6-{4-[4-(2-méthyl-2-propanyl)benzyl]-1-pipéridinyl}-4-pyrimidinamine [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 628.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.0±3.0 kJ/mol
Flash Point: 334.0±31.5 °C
Index of Refraction: 1.579
Molar Refractivity: 166.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 9.68
ACD/LogD (pH 5.5): 6.70
ACD/BCF (pH 5.5): 27744.28
ACD/KOC (pH 5.5): 16693.23
ACD/LogD (pH 7.4): 8.19
ACD/BCF (pH 7.4): 853810.88
ACD/KOC (pH 7.4): 513722.56
Polar Surface Area: 41 Å2
Polarizability: 65.8±0.5 10-24cm3
Surface Tension: 46.3±3.0 dyne/cm
Molar Volume: 499.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement