ChemSpider 2D Image | 2-(4-Fluorophenyl)-1-{4-[4-methyl-6-(4-morpholinyl)-2-pyrimidinyl]-1-piperazinyl}ethanone | C21H26FN5O2

2-(4-Fluorophenyl)-1-{4-[4-methyl-6-(4-morpholinyl)-2-pyrimidinyl]-1-piperazinyl}ethanone

  • Molecular FormulaC21H26FN5O2
  • Average mass399.462 Da
  • Monoisotopic mass399.207062 Da
  • ChemSpider ID26564900

More details:

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

2-(4-Fluorophenyl)-1-{4-[4-methyl-6-(4-morpholinyl)-2-pyrimidinyl]-1-piperazinyl}ethanone [ACD/IUPAC Name]
2-(4-Fluorophényl)-1-{4-[4-méthyl-6-(4-morpholinyl)-2-pyrimidinyl]-1-pipérazinyl}éthanone [French] [ACD/IUPAC Name]
2-(4-Fluorphenyl)-1-{4-[4-methyl-6-(4-morpholinyl)-2-pyrimidinyl]-1-piperazinyl}ethanon [German] [ACD/IUPAC Name]
Ethanone, 2-(4-fluorophenyl)-1-[4-[4-methyl-6-(4-morpholinyl)-2-pyrimidinyl]-1-piperazinyl]- [ACD/Index Name]
1226428-39-2 [RN]
2-(4-fluorophenyl)-1-(4-(4-methyl-6-morpholinopyrimidin-2-yl)piperazin-1-yl)ethanone
2-(4-fluorophenyl)-1-{4-[4-methyl-6-(morpholin-4-yl)pyrimidin-2-yl]piperazin-1-yl}ethan-1-one
4-(2-{4-[(4-fluorophenyl)acetyl]-1-piperazinyl}-6-methyl-4-pyrimidinyl)morpholine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 655.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.5±3.0 kJ/mol
Flash Point: 350.1±34.3 °C
Index of Refraction: 1.592
Molar Refractivity: 106.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.73
ACD/LogD (pH 5.5): -0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.39
ACD/LogD (pH 7.4): -0.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.43
Polar Surface Area: 62 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 315.0±3.0 cm3

Click to predict properties on the Chemicalize site


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