ChemSpider 2D Image | Methyl [4-(1-{[2-(4-morpholinyl)ethyl]amino}ethylidene)-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl]acetate | C20H26N4O4

Methyl [4-(1-{[2-(4-morpholinyl)ethyl]amino}ethylidene)-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl]acetate

  • Molecular FormulaC20H26N4O4
  • Average mass386.445 Da
  • Monoisotopic mass386.195404 Da
  • ChemSpider ID35321520

More details:

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

[4-(1-{[2-(4-Morpholinyl)éthyl]amino}éthylidène)-5-oxo-1-phényl-4,5-dihydro-1H-pyrazol-3-yl]acétate de méthyle [French] [ACD/IUPAC Name]
1H-Pyrazole-3-acetic acid, 4,5-dihydro-4-[1-[[2-(4-morpholinyl)ethyl]amino]ethylidene]-5-oxo-1-phenyl-, methyl ester [ACD/Index Name]
Methyl [4-(1-{[2-(4-morpholinyl)ethyl]amino}ethylidene)-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl]acetate [ACD/IUPAC Name]
Methyl-[4-(1-{[2-(4-morpholinyl)ethyl]amino}ethyliden)-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl]acetat [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: 512.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.4±3.0 kJ/mol
Flash Point: 263.9±32.9 °C
Index of Refraction: 1.604
Molar Refractivity: 105.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.75
ACD/LogD (pH 5.5): -1.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.13
ACD/BCF (pH 7.4): 3.56
ACD/KOC (pH 7.4): 70.08
Polar Surface Area: 83 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 48.0±7.0 dyne/cm
Molar Volume: 305.7±7.0 cm3

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