ChemSpider 2D Image | {3-[2-(4-Methyl-1-piperazinyl)-5-(3-pyridinyl)-4-pyrimidinyl]-1-piperidinyl}(2-pyrazinyl)methanone | C24H28N8O

{3-[2-(4-Methyl-1-piperazinyl)-5-(3-pyridinyl)-4-pyrimidinyl]-1-piperidinyl}(2-pyrazinyl)methanone

  • Molecular FormulaC24H28N8O
  • Average mass444.532 Da
  • Monoisotopic mass444.238617 Da
  • ChemSpider ID24983028

More details:

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

{3-[2-(4-Methyl-1-piperazinyl)-5-(3-pyridinyl)-4-pyrimidinyl]-1-piperidinyl}(2-pyrazinyl)methanon [German] [ACD/IUPAC Name]
{3-[2-(4-Methyl-1-piperazinyl)-5-(3-pyridinyl)-4-pyrimidinyl]-1-piperidinyl}(2-pyrazinyl)methanone [ACD/IUPAC Name]
{3-[2-(4-Méthyl-1-pipérazinyl)-5-(3-pyridinyl)-4-pyrimidinyl]-1-pipéridinyl}(2-pyrazinyl)méthanone [French] [ACD/IUPAC Name]
Methanone, [3-[2-(4-methyl-1-piperazinyl)-5-(3-pyridinyl)-4-pyrimidinyl]-1-piperidinyl]-2-pyrazinyl- [ACD/Index Name]
2-(4-METHYLPIPERAZIN-1-YL)-4-[1-(PYRAZINE-2-CARBONYL)PIPERIDIN-3-YL]-5-(PYRIDIN-3-YL)PYRIMIDINE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 685.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.5±3.0 kJ/mol
Flash Point: 368.0±34.3 °C
Index of Refraction: 1.621
Molar Refractivity: 124.2±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.82
ACD/LogD (pH 5.5): -0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.87
ACD/LogD (pH 7.4): 1.15
ACD/BCF (pH 7.4): 4.12
ACD/KOC (pH 7.4): 89.25
Polar Surface Area: 91 Å2
Polarizability: 49.3±0.5 10-24cm3
Surface Tension: 61.4±3.0 dyne/cm
Molar Volume: 353.4±3.0 cm3

Click to predict properties on the Chemicalize site


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