ChemSpider 2D Image | {4-[2-Methyl-6-(trifluoromethyl)-4-pyrimidinyl]-1-piperazinyl}(1-phenylcyclopropyl)methanone | C20H21F3N4O

{4-[2-Methyl-6-(trifluoromethyl)-4-pyrimidinyl]-1-piperazinyl}(1-phenylcyclopropyl)methanone

  • Molecular FormulaC20H21F3N4O
  • Average mass390.402 Da
  • Monoisotopic mass390.166748 Da
  • ChemSpider ID34486458

More details:

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

{4-[2-Methyl-6-(trifluormethyl)-4-pyrimidinyl]-1-piperazinyl}(1-phenylcyclopropyl)methanon [German] [ACD/IUPAC Name]
{4-[2-Methyl-6-(trifluoromethyl)-4-pyrimidinyl]-1-piperazinyl}(1-phenylcyclopropyl)methanone [ACD/IUPAC Name]
{4-[2-Méthyl-6-(trifluorométhyl)-4-pyrimidinyl]-1-pipérazinyl}(1-phénylcyclopropyl)méthanone [French] [ACD/IUPAC Name]
Methanone, [4-[2-methyl-6-(trifluoromethyl)-4-pyrimidinyl]-1-piperazinyl](1-phenylcyclopropyl)- [ACD/Index Name]
(4-(2-methyl-6-(trifluoromethyl)pyrimidin-4-yl)piperazin-1-yl)(1-phenylcyclopropyl)methanone
2034264-99-6 [RN]
2-methyl-4-[4-(1-phenylcyclopropanecarbonyl)piperazin-1-yl]-6-(trifluoromethyl)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: 536.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.3±3.0 kJ/mol
Flash Point: 278.2±30.1 °C
Index of Refraction: 1.577
Molar Refractivity: 96.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.37
ACD/LogD (pH 5.5): 2.55
ACD/BCF (pH 5.5): 50.73
ACD/KOC (pH 5.5): 577.63
ACD/LogD (pH 7.4): 2.55
ACD/BCF (pH 7.4): 50.96
ACD/KOC (pH 7.4): 580.27
Polar Surface Area: 49 Å2
Polarizability: 38.4±0.5 10-24cm3
Surface Tension: 52.0±3.0 dyne/cm
Molar Volume: 292.2±3.0 cm3

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