ChemSpider 2D Image | 4-Cyclopropyl-1-(4-fluorophenyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-1,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one | C21H22FN5O2

4-Cyclopropyl-1-(4-fluorophenyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-1,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one

  • Molecular FormulaC21H22FN5O2
  • Average mass395.430 Da
  • Monoisotopic mass395.175751 Da
  • ChemSpider ID22530100

More details:

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

4-Cyclopropyl-1-(4-fluorophenyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-1,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one [ACD/IUPAC Name]
4-Cyclopropyl-1-(4-fluorophényl)-6-[2-oxo-2-(1-pipéridinyl)éthyl]-1,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-one [French] [ACD/IUPAC Name]
4-Cyclopropyl-1-(4-fluorphenyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-1,6-dihydro-7H-pyrazolo[3,4-d]pyridazin-7-on [German] [ACD/IUPAC Name]
7H-Pyrazolo[3,4-d]pyridazin-7-one, 4-cyclopropyl-1-(4-fluorophenyl)-1,6-dihydro-6-[2-oxo-2-(1-piperidinyl)ethyl]- [ACD/Index Name]
1105237-07-7 [RN]
4-cyclopropyl-1-(4-fluorophenyl)-6-(2-oxo-2-(piperidin-1-yl)ethyl)-1H-pyrazolo[3,4-d]pyridazin-7(6H)-one
4-cyclopropyl-1-(4-fluorophenyl)-6-[2-oxo-2-(piperidin-1-yl)ethyl]-1H,6H,7H-pyrazolo[3,4-d]pyridazin-7-one

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

Density: 1.5±0.1 g/cm3
Boiling Point: 608.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.4±3.0 kJ/mol
Flash Point: 322.0±34.3 °C
Index of Refraction: 1.726
Molar Refractivity: 106.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.45
ACD/LogD (pH 5.5): 1.75
ACD/BCF (pH 5.5): 12.61
ACD/KOC (pH 5.5): 213.56
ACD/LogD (pH 7.4): 1.75
ACD/BCF (pH 7.4): 12.61
ACD/KOC (pH 7.4): 213.56
Polar Surface Area: 71 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 60.3±7.0 dyne/cm
Molar Volume: 267.2±7.0 cm3

Click to predict properties on the Chemicalize site


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