ChemSpider 2D Image | 3-[4-(6-Ethyl-5-fluoro-4-pyrimidinyl)-1-piperazinyl]-6-(1H-pyrazol-1-yl)pyridazine | C17H19FN8

3-[4-(6-Ethyl-5-fluoro-4-pyrimidinyl)-1-piperazinyl]-6-(1H-pyrazol-1-yl)pyridazine

  • Molecular FormulaC17H19FN8
  • Average mass354.385 Da
  • Monoisotopic mass354.171661 Da
  • ChemSpider ID84398006

More details:

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

3-[4-(6-Ethyl-5-fluor-4-pyrimidinyl)-1-piperazinyl]-6-(1H-pyrazol-1-yl)pyridazin [German] [ACD/IUPAC Name]
3-[4-(6-Ethyl-5-fluoro-4-pyrimidinyl)-1-piperazinyl]-6-(1H-pyrazol-1-yl)pyridazine [ACD/IUPAC Name]
3-[4-(6-Éthyl-5-fluoro-4-pyrimidinyl)-1-pipérazinyl]-6-(1H-pyrazol-1-yl)pyridazine [French] [ACD/IUPAC Name]
Pyridazine, 3-[4-(6-ethyl-5-fluoro-4-pyrimidinyl)-1-piperazinyl]-6-(1H-pyrazol-1-yl)- [ACD/Index Name]
2415455-60-4 [RN]
4-ethyl-5-fluoro-6-{4-[6-(1H-pyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl}pyrimidine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 616.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.4±3.0 kJ/mol
Flash Point: 326.3±31.5 °C
Index of Refraction: 1.708
Molar Refractivity: 97.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.06
ACD/LogD (pH 5.5): 0.36
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.35
ACD/LogD (pH 7.4): 1.66
ACD/BCF (pH 7.4): 10.12
ACD/KOC (pH 7.4): 168.14
Polar Surface Area: 76 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 56.4±7.0 dyne/cm
Molar Volume: 250.1±7.0 cm3

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