ChemSpider 2D Image | {4-[6-(4-Methyl-1-piperazinyl)-3-pyridazinyl]-1-piperazinyl}(2,4,5-trifluoro-3-methoxyphenyl)methanone | C21H25F3N6O2

{4-[6-(4-Methyl-1-piperazinyl)-3-pyridazinyl]-1-piperazinyl}(2,4,5-trifluoro-3-methoxyphenyl)methanone

  • Molecular FormulaC21H25F3N6O2
  • Average mass450.457 Da
  • Monoisotopic mass450.199097 Da
  • ChemSpider ID58449766

More details:

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

{4-[6-(4-Methyl-1-piperazinyl)-3-pyridazinyl]-1-piperazinyl}(2,4,5-trifluor-3-methoxyphenyl)methanon [German] [ACD/IUPAC Name]
{4-[6-(4-Methyl-1-piperazinyl)-3-pyridazinyl]-1-piperazinyl}(2,4,5-trifluoro-3-methoxyphenyl)methanone [ACD/IUPAC Name]
{4-[6-(4-Méthyl-1-pipérazinyl)-3-pyridazinyl]-1-pipérazinyl}(2,4,5-trifluoro-3-méthoxyphényl)méthanone [French] [ACD/IUPAC Name]
Methanone, [4-[6-(4-methyl-1-piperazinyl)-3-pyridazinyl]-1-piperazinyl](2,4,5-trifluoro-3-methoxyphenyl)- [ACD/Index Name]
(4-(6-(4-methylpiperazin-1-yl)pyridazin-3-yl)piperazin-1-yl)(2,4,5-trifluoro-3-methoxyphenyl)methanone

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

Density: 1.3±0.1 g/cm3
Boiling Point: 665.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.8±3.0 kJ/mol
Flash Point: 356.1±31.5 °C
Index of Refraction: 1.574
Molar Refractivity: 111.0±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.41
ACD/LogD (pH 5.5): -0.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.26
ACD/BCF (pH 7.4): 4.46
ACD/KOC (pH 7.4): 82.21
Polar Surface Area: 65 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 336.2±3.0 cm3

Click to predict properties on the Chemicalize site


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