ChemSpider 2D Image | 2-(2,4-Difluorophenyl)-1-(4-{6-[4-(2-hydroxyethyl)-1-piperazinyl]-3-pyridazinyl}-1-piperazinyl)ethanone | C22H28F2N6O2

2-(2,4-Difluorophenyl)-1-(4-{6-[4-(2-hydroxyethyl)-1-piperazinyl]-3-pyridazinyl}-1-piperazinyl)ethanone

  • Molecular FormulaC22H28F2N6O2
  • Average mass446.493 Da
  • Monoisotopic mass446.224182 Da
  • ChemSpider ID58334660

More details:

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

2-(2,4-Difluorophenyl)-1-(4-{6-[4-(2-hydroxyethyl)-1-piperazinyl]-3-pyridazinyl}-1-piperazinyl)ethanone [ACD/IUPAC Name]
2-(2,4-Difluorophényl)-1-(4-{6-[4-(2-hydroxyéthyl)-1-pipérazinyl]-3-pyridazinyl}-1-pipérazinyl)éthanone [French] [ACD/IUPAC Name]
2-(2,4-Difluorphenyl)-1-(4-{6-[4-(2-hydroxyethyl)-1-piperazinyl]-3-pyridazinyl}-1-piperazinyl)ethanon [German] [ACD/IUPAC Name]
Ethanone, 2-(2,4-difluorophenyl)-1-[4-[6-[4-(2-hydroxyethyl)-1-piperazinyl]-3-pyridazinyl]-1-piperazinyl]- [ACD/Index Name]
2-(2,4-difluorophenyl)-1-(4-(6-(4-(2-hydroxyethyl)piperazin-1-yl)pyridazin-3-yl)piperazin-1-yl)ethanone

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

Density: 1.3±0.1 g/cm3
Boiling Point: 717.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 110.1±3.0 kJ/mol
Flash Point: 387.8±32.9 °C
Index of Refraction: 1.593
Molar Refractivity: 114.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.65
ACD/LogD (pH 5.5): -1.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.87
ACD/BCF (pH 7.4): 2.31
ACD/KOC (pH 7.4): 52.31
Polar Surface Area: 76 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 57.5±3.0 dyne/cm
Molar Volume: 338.0±3.0 cm3

Click to predict properties on the Chemicalize site


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