ChemSpider 2D Image | [4-(2,5-Dimethylphenyl)-1-piperazinyl]{1-[6-(1H-pyrazol-1-yl)-3-pyridazinyl]-4-piperidinyl}methanone | C25H31N7O

[4-(2,5-Dimethylphenyl)-1-piperazinyl]{1-[6-(1H-pyrazol-1-yl)-3-pyridazinyl]-4-piperidinyl}methanone

  • Molecular FormulaC25H31N7O
  • Average mass445.560 Da
  • Monoisotopic mass445.259003 Da
  • ChemSpider ID26305180

More details:

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

[4-(2,5-Dimethylphenyl)-1-piperazinyl]{1-[6-(1H-pyrazol-1-yl)-3-pyridazinyl]-4-piperidinyl}methanon [German] [ACD/IUPAC Name]
[4-(2,5-Dimethylphenyl)-1-piperazinyl]{1-[6-(1H-pyrazol-1-yl)-3-pyridazinyl]-4-piperidinyl}methanone [ACD/IUPAC Name]
[4-(2,5-Diméthylphényl)-1-pipérazinyl]{1-[6-(1H-pyrazol-1-yl)-3-pyridazinyl]-4-pipéridinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, [4-(2,5-dimethylphenyl)-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-(2,5-dimethylphenyl)piperazin-1-yl)methanone
1286711-09-8 [RN]
3-{4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]piperidin-1-yl}-6-(1H-pyrazol-1-yl)pyridazine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 722.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.5±3.0 kJ/mol
Flash Point: 390.4±32.9 °C
Index of Refraction: 1.681
Molar Refractivity: 130.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.74
ACD/LogD (pH 5.5): 2.96
ACD/BCF (pH 5.5): 103.49
ACD/KOC (pH 5.5): 957.90
ACD/LogD (pH 7.4): 2.97
ACD/BCF (pH 7.4): 105.64
ACD/KOC (pH 7.4): 977.76
Polar Surface Area: 70 Å2
Polarizability: 51.7±0.5 10-24cm3
Surface Tension: 53.3±7.0 dyne/cm
Molar Volume: 344.9±7.0 cm3

Click to predict properties on the Chemicalize site


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