ChemSpider 2D Image | 2-Fluoro-N-[1-(2-oxo-2-{[3-(3-pyridinyloxy)propyl]amino}ethyl)-1H-pyrazol-4-yl]benzamide | C20H20FN5O3

2-Fluoro-N-[1-(2-oxo-2-{[3-(3-pyridinyloxy)propyl]amino}ethyl)-1H-pyrazol-4-yl]benzamide

  • Molecular FormulaC20H20FN5O3
  • Average mass397.403 Da
  • Monoisotopic mass397.155029 Da
  • ChemSpider ID22187204

More details:

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

1H-Pyrazole-1-acetamide, 4-[(2-fluorobenzoyl)amino]-N-[3-(3-pyridinyloxy)propyl]- [ACD/Index Name]
2-Fluor-N-[1-(2-oxo-2-{[3-(3-pyridinyloxy)propyl]amino}ethyl)-1H-pyrazol-4-yl]benzamid [German] [ACD/IUPAC Name]
2-Fluoro-N-[1-(2-oxo-2-{[3-(3-pyridinyloxy)propyl]amino}ethyl)-1H-pyrazol-4-yl]benzamide [ACD/IUPAC Name]
2-Fluoro-N-[1-(2-oxo-2-{[3-(3-pyridinyloxy)propyl]amino}éthyl)-1H-pyrazol-4-yl]benzamide [French] [ACD/IUPAC Name]
2-FLUORO-N-[1-({[3-(PYRIDIN-3-YLOXY)PROPYL]CARBAMOYL}METHYL)-1H-PYRAZOL-4-YL]BENZAMIDE
2-FLUORO-N-[1-({[3-(PYRIDIN-3-YLOXY)PROPYL]CARBAMOYL}METHYL)PYRAZOL-4-YL]BENZAMIDE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 599.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.3±3.0 kJ/mol
Flash Point: 316.6±30.1 °C
Index of Refraction: 1.620
Molar Refractivity: 106.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 0.86
ACD/LogD (pH 5.5): 1.19
ACD/BCF (pH 5.5): 4.55
ACD/KOC (pH 5.5): 98.91
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 5.22
ACD/KOC (pH 7.4): 113.59
Polar Surface Area: 98 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 50.4±7.0 dyne/cm
Molar Volume: 302.4±7.0 cm3

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