ChemSpider 2D Image | N-(4-Ethylphenyl)-2-(2-methylphenyl)-6-{4-[4-(2-methyl-2-propanyl)benzyl]-1-piperidinyl}-4-pyrimidinamine | C35H42N4

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

  • Molecular FormulaC35H42N4
  • Average mass518.735 Da
  • Monoisotopic mass518.340942 Da
  • ChemSpider ID121421128

More details:

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

4-Pyrimidinamine, 6-[4-[[4-(1,1-dimethylethyl)phenyl]methyl]-1-piperidinyl]-N-(4-ethylphenyl)-2-(2-methylphenyl)- [ACD/Index Name]
N-(4-Ethylphenyl)-2-(2-methylphenyl)-6-{4-[4-(2-methyl-2-propanyl)benzyl]-1-piperidinyl}-4-pyrimidinamin [German] [ACD/IUPAC Name]
N-(4-Ethylphenyl)-2-(2-methylphenyl)-6-{4-[4-(2-methyl-2-propanyl)benzyl]-1-piperidinyl}-4-pyrimidinamine [ACD/IUPAC Name]
N-(4-Éthylphényl)-2-(2-méthylphényl)-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: 615.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.4±3.0 kJ/mol
Flash Point: 326.2±31.5 °C
Index of Refraction: 1.605
Molar Refractivity: 163.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 8.92
ACD/LogD (pH 5.5): 7.04
ACD/BCF (pH 5.5): 61124.43
ACD/KOC (pH 5.5): 37386.25
ACD/LogD (pH 7.4): 8.31
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 694358.44
Polar Surface Area: 41 Å2
Polarizability: 64.7±0.5 10-24cm3
Surface Tension: 48.2±3.0 dyne/cm
Molar Volume: 473.6±3.0 cm3

Click to predict properties on the Chemicalize site


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