ChemSpider 2D Image | N-[2-(5-Fluoro-1H-benzimidazol-2-yl)ethyl]-5-methyl-4-(1-methyl-1H-pyrazol-5-yl)-2-pyrimidinamine | C18H18FN7

N-[2-(5-Fluoro-1H-benzimidazol-2-yl)ethyl]-5-methyl-4-(1-methyl-1H-pyrazol-5-yl)-2-pyrimidinamine

  • Molecular FormulaC18H18FN7
  • Average mass351.381 Da
  • Monoisotopic mass351.160767 Da
  • ChemSpider ID23981980

More details:

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

1H-Benzimidazole-2-ethanamine, 5-fluoro-N-[5-methyl-4-(1-methyl-1H-pyrazol-5-yl)-2-pyrimidinyl]- [ACD/Index Name]
N-[2-(5-Fluor-1H-benzimidazol-2-yl)ethyl]-5-methyl-4-(1-methyl-1H-pyrazol-5-yl)-2-pyrimidinamin [German] [ACD/IUPAC Name]
N-[2-(5-Fluoro-1H-benzimidazol-2-yl)ethyl]-5-methyl-4-(1-methyl-1H-pyrazol-5-yl)-2-pyrimidinamine [ACD/IUPAC Name]
N-[2-(5-Fluoro-1H-benzimidazol-2-yl)éthyl]-5-méthyl-4-(1-méthyl-1H-pyrazol-5-yl)-2-pyrimidinamine [French] [ACD/IUPAC Name]
N-[2-(6-fluoro-1H-benzimidazol-2-yl)ethyl]-5-methyl-4-(1-methyl-1H-pyrazol-5-yl)pyrimidin-2-amine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 640.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.5±3.0 kJ/mol
Flash Point: 341.1±34.3 °C
Index of Refraction: 1.710
Molar Refractivity: 97.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.32
ACD/LogD (pH 5.5): 2.35
ACD/BCF (pH 5.5): 31.76
ACD/KOC (pH 5.5): 359.76
ACD/LogD (pH 7.4): 2.56
ACD/BCF (pH 7.4): 51.52
ACD/KOC (pH 7.4): 583.55
Polar Surface Area: 84 Å2
Polarizability: 38.5±0.5 10-24cm3
Surface Tension: 52.3±7.0 dyne/cm
Molar Volume: 248.4±7.0 cm3

Click to predict properties on the Chemicalize site


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