ChemSpider 2D Image | 4-Amino-6-(4-{1-[2-(1-azetidinyl)ethyl]-4-(2-fluorophenyl)-1H-imidazol-2-yl}-1-piperidinyl)-5-pyrimidinecarbonitrile | C24H27FN8

4-Amino-6-(4-{1-[2-(1-azetidinyl)ethyl]-4-(2-fluorophenyl)-1H-imidazol-2-yl}-1-piperidinyl)-5-pyrimidinecarbonitrile

  • Molecular FormulaC24H27FN8
  • Average mass446.523 Da
  • Monoisotopic mass446.234283 Da
  • ChemSpider ID61720459

More details:

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

4-Amino-6-(4-{1-[2-(1-azetidinyl)ethyl]-4-(2-fluorophenyl)-1H-imidazol-2-yl}-1-piperidinyl)-5-pyrimidinecarbonitrile [ACD/IUPAC Name]
4-Amino-6-(4-{1-[2-(1-azétidinyl)éthyl]-4-(2-fluorophényl)-1H-imidazol-2-yl}-1-pipéridinyl)-5-pyrimidinecarbonitrile [French] [ACD/IUPAC Name]
4-Amino-6-(4-{1-[2-(1-azetidinyl)ethyl]-4-(2-fluorphenyl)-1H-imidazol-2-yl}-1-piperidinyl)-5-pyrimidincarbonitril [German] [ACD/IUPAC Name]
5-Pyrimidinecarbonitrile, 4-amino-6-[4-[1-[2-(1-azetidinyl)ethyl]-4-(2-fluorophenyl)-1H-imidazol-2-yl]-1-piperidinyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 745.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.8±3.0 kJ/mol
Flash Point: 404.9±32.9 °C
Index of Refraction: 1.714
Molar Refractivity: 125.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.60
ACD/LogD (pH 5.5): 0.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.01
ACD/LogD (pH 7.4): 1.76
ACD/BCF (pH 7.4): 5.46
ACD/KOC (pH 7.4): 42.83
Polar Surface Area: 100 Å2
Polarizability: 49.6±0.5 10-24cm3
Surface Tension: 58.8±7.0 dyne/cm
Molar Volume: 319.0±7.0 cm3

Click to predict properties on the Chemicalize site


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