ChemSpider 2D Image | 1-(2-Fluorophenyl)-3-(2-{[5-(1-pyrrolidinyl)-3-pyridazinyl]amino}ethyl)urea | C17H21FN6O

1-(2-Fluorophenyl)-3-(2-{[5-(1-pyrrolidinyl)-3-pyridazinyl]amino}ethyl)urea

  • Molecular FormulaC17H21FN6O
  • Average mass344.387 Da
  • Monoisotopic mass344.176086 Da
  • ChemSpider ID30761217

More details:

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

1-(2-Fluorophenyl)-3-(2-{[5-(1-pyrrolidinyl)-3-pyridazinyl]amino}ethyl)urea [ACD/IUPAC Name]
1-(2-Fluorophényl)-3-(2-{[5-(1-pyrrolidinyl)-3-pyridazinyl]amino}éthyl)urée [French] [ACD/IUPAC Name]
1-(2-Fluorphenyl)-3-(2-{[5-(1-pyrrolidinyl)-3-pyridazinyl]amino}ethyl)harnstoff [German] [ACD/IUPAC Name]
Urea, N-(2-fluorophenyl)-N'-[2-[[5-(1-pyrrolidinyl)-3-pyridazinyl]amino]ethyl]- [ACD/Index Name]
1-(2-fluorophenyl)-3-(2-((5-(pyrrolidin-1-yl)pyridazin-3-yl)amino)ethyl)urea
1-(2-fluorophenyl)-3-(2-{[5-(pyrrolidin-1-yl)pyridazin-3-yl]amino}ethyl)urea
1796964-28-7 [RN]
3-(2-FLUOROPHENYL)-1-(2-{[5-(PYRROLIDIN-1-YL)PYRIDAZIN-3-YL]AMINO}ETHYL)UREA

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

Density: 1.3±0.1 g/cm3
Boiling Point: 597.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.0±3.0 kJ/mol
Flash Point: 315.0±30.1 °C
Index of Refraction: 1.655
Molar Refractivity: 94.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.94
ACD/LogD (pH 5.5): -0.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.30
ACD/LogD (pH 7.4): -0.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.98
Polar Surface Area: 82 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 69.4±3.0 dyne/cm
Molar Volume: 256.9±3.0 cm3

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