ChemSpider 2D Image | 6-(4-{1-[2-(1-Azetidinyl)ethyl]-4-(2-methoxy-4-pyridinyl)-1H-imidazol-2-yl}-1-piperidinyl)-5-ethyl-4-pyrimidinamine | C25H34N8O

6-(4-{1-[2-(1-Azetidinyl)ethyl]-4-(2-methoxy-4-pyridinyl)-1H-imidazol-2-yl}-1-piperidinyl)-5-ethyl-4-pyrimidinamine

  • Molecular FormulaC25H34N8O
  • Average mass462.591 Da
  • Monoisotopic mass462.285553 Da
  • ChemSpider ID61720237

More details:

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

4-Pyrimidinamine, 6-[4-[1-[2-(1-azetidinyl)ethyl]-4-(2-methoxy-4-pyridinyl)-1H-imidazol-2-yl]-1-piperidinyl]-5-ethyl- [ACD/Index Name]
6-(4-{1-[2-(1-Azetidinyl)ethyl]-4-(2-methoxy-4-pyridinyl)-1H-imidazol-2-yl}-1-piperidinyl)-5-ethyl-4-pyrimidinamin [German] [ACD/IUPAC Name]
6-(4-{1-[2-(1-Azetidinyl)ethyl]-4-(2-methoxy-4-pyridinyl)-1H-imidazol-2-yl}-1-piperidinyl)-5-ethyl-4-pyrimidinamine [ACD/IUPAC Name]
6-(4-{1-[2-(1-Azétidinyl)éthyl]-4-(2-méthoxy-4-pyridinyl)-1H-imidazol-2-yl}-1-pipéridinyl)-5-éthyl-4-pyrimidinamine [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 716.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.8±3.0 kJ/mol
Flash Point: 387.3±32.9 °C
Index of Refraction: 1.692
Molar Refractivity: 132.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.28
ACD/LogD (pH 5.5): -1.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 2.01
ACD/KOC (pH 7.4): 18.52
Polar Surface Area: 98 Å2
Polarizability: 52.3±0.5 10-24cm3
Surface Tension: 54.9±7.0 dyne/cm
Molar Volume: 344.8±7.0 cm3

Click to predict properties on the Chemicalize site


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