ChemSpider 2D Image | 6-Amino-5-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N-{4-[(3,3-dimethyl-1-piperazinyl)carbonyl]phenyl}-3-pyridazinecarboxamide | C26H27Cl2FN6O3

6-Amino-5-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N-{4-[(3,3-dimethyl-1-piperazinyl)carbonyl]phenyl}-3-pyridazinecarboxamide

  • Molecular FormulaC26H27Cl2FN6O3
  • Average mass561.435 Da
  • Monoisotopic mass560.150574 Da
  • ChemSpider ID76797688

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

3-Pyridazinecarboxamide, 6-amino-5-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N-[4-[(3,3-dimethyl-1-piperazinyl)carbonyl]phenyl]- [ACD/Index Name]
6-Amino-5-[(1R)-1-(2,6-dichlor-3-fluorphenyl)ethoxy]-N-{4-[(3,3-dimethyl-1-piperazinyl)carbonyl]phenyl}-3-pyridazincarboxamid [German] [ACD/IUPAC Name]
6-Amino-5-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N-{4-[(3,3-dimethyl-1-piperazinyl)carbonyl]phenyl}-3-pyridazinecarboxamide [ACD/IUPAC Name]
6-Amino-5-[(1R)-1-(2,6-dichloro-3-fluorophényl)éthoxy]-N-{4-[(3,3-diméthyl-1-pipérazinyl)carbonyl]phényl}-3-pyridazinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 703.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.0±3.0 kJ/mol
Flash Point: 379.5±32.9 °C
Index of Refraction: 1.631
Molar Refractivity: 144.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.75
ACD/LogD (pH 5.5): 1.62
ACD/BCF (pH 5.5): 2.78
ACD/KOC (pH 5.5): 15.74
ACD/LogD (pH 7.4): 3.33
ACD/BCF (pH 7.4): 140.86
ACD/KOC (pH 7.4): 796.40
Polar Surface Area: 122 Å2
Polarizability: 57.4±0.5 10-24cm3
Surface Tension: 59.1±3.0 dyne/cm
Molar Volume: 406.6±3.0 cm3

Click to predict properties on the Chemicalize site


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