ChemSpider 2D Image | Isopropyl 3-(2-chlorophenyl)-3-({[1-(6-ethoxy-3-pyridazinyl)-5-methyl-1H-pyrazol-4-yl]carbonyl}amino)propanoate | C23H26ClN5O4

Isopropyl 3-(2-chlorophenyl)-3-({[1-(6-ethoxy-3-pyridazinyl)-5-methyl-1H-pyrazol-4-yl]carbonyl}amino)propanoate

  • Molecular FormulaC23H26ClN5O4
  • Average mass471.937 Da
  • Monoisotopic mass471.167328 Da
  • ChemSpider ID31075829

More details:

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

3-(2-Chlorophényl)-3-({[1-(6-éthoxy-3-pyridazinyl)-5-méthyl-1H-pyrazol-4-yl]carbonyl}amino)propanoate d'isopropyle [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 2-chloro-β-[[[1-(6-ethoxy-3-pyridazinyl)-5-methyl-1H-pyrazol-4-yl]carbonyl]amino]-, 1-methylethyl ester [ACD/Index Name]
Isopropyl 3-(2-chlorophenyl)-3-({[1-(6-ethoxy-3-pyridazinyl)-5-methyl-1H-pyrazol-4-yl]carbonyl}amino)propanoate [ACD/IUPAC Name]
Isopropyl-3-(2-chlorphenyl)-3-({[1-(6-ethoxy-3-pyridazinyl)-5-methyl-1H-pyrazol-4-yl]carbonyl}amino)propanoat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 684.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.3±3.0 kJ/mol
Flash Point: 367.5±31.5 °C
Index of Refraction: 1.614
Molar Refractivity: 125.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.84
ACD/LogD (pH 5.5): 3.84
ACD/BCF (pH 5.5): 490.62
ACD/KOC (pH 5.5): 2935.14
ACD/LogD (pH 7.4): 3.84
ACD/BCF (pH 7.4): 490.64
ACD/KOC (pH 7.4): 2935.31
Polar Surface Area: 108 Å2
Polarizability: 49.7±0.5 10-24cm3
Surface Tension: 46.4±7.0 dyne/cm
Molar Volume: 360.0±7.0 cm3

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