ChemSpider 2D Image | 4-Chloro-5-[4-(tetrahydro-2-furanylmethyl)-1-piperazinyl]-2-[5-(trifluoromethyl)-2-pyridinyl]-3(2H)-pyridazinone | C19H21ClF3N5O2

4-Chloro-5-[4-(tetrahydro-2-furanylmethyl)-1-piperazinyl]-2-[5-(trifluoromethyl)-2-pyridinyl]-3(2H)-pyridazinone

  • Molecular FormulaC19H21ClF3N5O2
  • Average mass443.850 Da
  • Monoisotopic mass443.133575 Da
  • ChemSpider ID31061190

More details:

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

3(2H)-Pyridazinone, 4-chloro-5-[4-[(tetrahydro-2-furanyl)methyl]-1-piperazinyl]-2-[5-(trifluoromethyl)-2-pyridinyl]- [ACD/Index Name]
4-Chlor-5-[4-(tetrahydro-2-furanylmethyl)-1-piperazinyl]-2-[5-(trifluormethyl)-2-pyridinyl]-3(2H)-pyridazinon [German] [ACD/IUPAC Name]
4-Chloro-5-[4-(tetrahydro-2-furanylmethyl)-1-piperazinyl]-2-[5-(trifluoromethyl)-2-pyridinyl]-3(2H)-pyridazinone [ACD/IUPAC Name]
4-Chloro-5-[4-(tétrahydro-2-furanylméthyl)-1-pipérazinyl]-2-[5-(trifluorométhyl)-2-pyridinyl]-3(2H)-pyridazinone [French] [ACD/IUPAC Name]
4-CHLORO-5-[4-(OXOLAN-2-YLMETHYL)PIPERAZIN-1-YL]-2-[5-(TRIFLUOROMETHYL)PYRIDIN-2-YL]PYRIDAZIN-3-ONE

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

Density: 1.5±0.1 g/cm3
Boiling Point: 514.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.6±3.0 kJ/mol
Flash Point: 265.0±32.9 °C
Index of Refraction: 1.634
Molar Refractivity: 104.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.37
ACD/LogD (pH 5.5): 1.26
ACD/BCF (pH 5.5): 3.34
ACD/KOC (pH 5.5): 47.52
ACD/LogD (pH 7.4): 2.07
ACD/BCF (pH 7.4): 21.53
ACD/KOC (pH 7.4): 306.83
Polar Surface Area: 61 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 50.1±7.0 dyne/cm
Molar Volume: 293.2±7.0 cm3

Click to predict properties on the Chemicalize site


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