ChemSpider 2D Image | 4-[3-fluoro-5-(4-morpholinyl)phenyl]-N-[4-[3-(4-morpholinyl)-1,2,4-triazol-1-yl]phenyl]-2-pyrimidinamine | C26H27FN8O2

4-[3-fluoro-5-(4-morpholinyl)phenyl]-N-[4-[3-(4-morpholinyl)-1,2,4-triazol-1-yl]phenyl]-2-pyrimidinamine

  • Molecular FormulaC26H27FN8O2
  • Average mass502.543 Da
  • Monoisotopic mass502.224091 Da
  • ChemSpider ID24642459

More details:

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

2-Pyrimidinamine, 4-[3-fluoro-5-(4-morpholinyl)phenyl]-N-[4-[3-(4-morpholinyl)-1H-1,2,4-triazol-1-yl]phenyl]- [ACD/Index Name]
4-[3-Fluor-5-(4-morpholinyl)phenyl]-N-{4-[3-(4-morpholinyl)-1H-1,2,4-triazol-1-yl]phenyl}-2-pyrimidinamin [German] [ACD/IUPAC Name]
4-[3-fluoro-5-(4-morpholinyl)phenyl]-N-[4-[3-(4-morpholinyl)-1,2,4-triazol-1-yl]phenyl]-2-pyrimidinamine
4-[3-Fluoro-5-(4-morpholinyl)phenyl]-N-{4-[3-(4-morpholinyl)-1H-1,2,4-triazol-1-yl]phenyl}-2-pyrimidinamine [ACD/IUPAC Name]
4-[3-Fluoro-5-(4-morpholinyl)phényl]-N-{4-[3-(4-morpholinyl)-1H-1,2,4-triazol-1-yl]phényl}-2-pyrimidinamine [French] [ACD/IUPAC Name]
1128096-64-9 [RN]
2-Pyrimidinamine,4-[3-fluoro-5-(4-morpholinyl)phenyl]-N-[4-[3-(4-morpholinyl)-1H-1,2,4-triazol-1-yl]phenyl]-
4-(3-fluoro-5-morpholinophenyl)-N-(4-(3-morpholino-1H-1,2,4-triazol-1-yl)phenyl)pyrimidin-2-amine
FMY
JNK inhibitor 9l
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 781.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.6±3.0 kJ/mol
Flash Point: 426.1±35.7 °C
Index of Refraction: 1.707
Molar Refractivity: 136.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 1.51
ACD/LogD (pH 5.5): 2.58
ACD/BCF (pH 5.5): 50.39
ACD/KOC (pH 5.5): 528.09
ACD/LogD (pH 7.4): 2.71
ACD/BCF (pH 7.4): 67.95
ACD/KOC (pH 7.4): 712.10
Polar Surface Area: 93 Å2
Polarizability: 54.3±0.5 10-24cm3
Surface Tension: 57.9±7.0 dyne/cm
Molar Volume: 351.3±7.0 cm3

Click to predict properties on the Chemicalize site


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