ChemSpider 2D Image | [4-(3-Chloro-4-fluorophenyl)-1-piperazinyl]{1-[6-(1H-pyrazol-1-yl)-3-pyridazinyl]-4-piperidinyl}methanone | C23H25ClFN7O

[4-(3-Chloro-4-fluorophenyl)-1-piperazinyl]{1-[6-(1H-pyrazol-1-yl)-3-pyridazinyl]-4-piperidinyl}methanone

  • Molecular FormulaC23H25ClFN7O
  • Average mass469.942 Da
  • Monoisotopic mass469.179321 Da
  • ChemSpider ID39335515

More details:

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

[4-(3-Chlor-4-fluorphenyl)-1-piperazinyl]{1-[6-(1H-pyrazol-1-yl)-3-pyridazinyl]-4-piperidinyl}methanon [German] [ACD/IUPAC Name]
[4-(3-Chloro-4-fluorophenyl)-1-piperazinyl]{1-[6-(1H-pyrazol-1-yl)-3-pyridazinyl]-4-piperidinyl}methanone [ACD/IUPAC Name]
[4-(3-Chloro-4-fluorophényl)-1-pipérazinyl]{1-[6-(1H-pyrazol-1-yl)-3-pyridazinyl]-4-pipéridinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, [4-(3-chloro-4-fluorophenyl)-1-piperazinyl][1-[6-(1H-pyrazol-1-yl)-3-pyridazinyl]-4-piperidinyl]- [ACD/Index Name]
(1-(6-(1H-pyrazol-1-yl)pyridazin-3-yl)piperidin-4-yl)(4-(3-chloro-4-fluorophenyl)piperazin-1-yl)methanone

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

Density: 1.4±0.1 g/cm3
Boiling Point: 738.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.8±3.0 kJ/mol
Flash Point: 400.6±32.9 °C
Index of Refraction: 1.699
Molar Refractivity: 126.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.97
ACD/LogD (pH 5.5): 3.13
ACD/BCF (pH 5.5): 139.89
ACD/KOC (pH 5.5): 1192.61
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 141.08
ACD/KOC (pH 7.4): 1202.77
Polar Surface Area: 70 Å2
Polarizability: 50.0±0.5 10-24cm3
Surface Tension: 57.3±7.0 dyne/cm
Molar Volume: 326.7±7.0 cm3

Click to predict properties on the Chemicalize site


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