ChemSpider 2D Image | 4-Chloro-5-{4-[2-(2-ethoxyphenoxy)ethyl]-1-piperazinyl}-2-{7-[4-(2-methoxyphenyl)-1-piperazinyl]heptyl}-3(2H)-pyridazinone | C36H51ClN6O4

4-Chloro-5-{4-[2-(2-ethoxyphenoxy)ethyl]-1-piperazinyl}-2-{7-[4-(2-methoxyphenyl)-1-piperazinyl]heptyl}-3(2H)-pyridazinone

  • Molecular FormulaC36H51ClN6O4
  • Average mass667.281 Da
  • Monoisotopic mass666.366028 Da
  • ChemSpider ID23143393

More details:

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

3(2H)-Pyridazinone, 4-chloro-5-[4-[2-(2-ethoxyphenoxy)ethyl]-1-piperazinyl]-2-[7-[4-(2-methoxyphenyl)-1-piperazinyl]heptyl]- [ACD/Index Name]
4-Chlor-5-{4-[2-(2-ethoxyphenoxy)ethyl]-1-piperazinyl}-2-{7-[4-(2-methoxyphenyl)-1-piperazinyl]heptyl}-3(2H)-pyridazinon [German] [ACD/IUPAC Name]
4-Chloro-5-{4-[2-(2-ethoxyphenoxy)ethyl]-1-piperazinyl}-2-{7-[4-(2-methoxyphenyl)-1-piperazinyl]heptyl}-3(2H)-pyridazinone [ACD/IUPAC Name]
4-Chloro-5-{4-[2-(2-éthoxyphénoxy)éthyl]-1-pipérazinyl}-2-{7-[4-(2-méthoxyphényl)-1-pipérazinyl]heptyl}-3(2H)-pyridazinone [French] [ACD/IUPAC Name]
4-Chloro-5-{4-[2-(2-ethoxy-phenoxy)-ethyl]-piperazin-1-yl}-2-{7-[4-(2-methoxy-phenyl)-piperazin-1-yl]-heptyl}-2H-pyridazin-3-one
CHEMBL48163

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

Density: 1.2±0.1 g/cm3
Boiling Point: 743.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.4±3.0 kJ/mol
Flash Point: 403.6±35.7 °C
Index of Refraction: 1.597
Molar Refractivity: 187.8±0.5 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 3
ACD/LogP: 5.67
ACD/LogD (pH 5.5): 1.64
ACD/BCF (pH 5.5): 1.60
ACD/KOC (pH 5.5): 5.32
ACD/LogD (pH 7.4): 4.40
ACD/BCF (pH 7.4): 922.08
ACD/KOC (pH 7.4): 3074.12
Polar Surface Area: 73 Å2
Polarizability: 74.5±0.5 10-24cm3
Surface Tension: 46.3±7.0 dyne/cm
Molar Volume: 551.2±7.0 cm3

Click to predict properties on the Chemicalize site


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