ChemSpider 2D Image | 4-{4-[2-(2-Methoxyphenyl)ethyl]-1-piperazinyl}-2-phenyl-6-{4-[(2E)-3-phenyl-2-propen-1-yl]-1-piperazinyl}pyrimidine | C36H42N6O

4-{4-[2-(2-Methoxyphenyl)ethyl]-1-piperazinyl}-2-phenyl-6-{4-[(2E)-3-phenyl-2-propen-1-yl]-1-piperazinyl}pyrimidine

  • Molecular FormulaC36H42N6O
  • Average mass574.758 Da
  • Monoisotopic mass574.341980 Da
  • ChemSpider ID121849786

  • Double-bond stereo - Double-bond stereo

More details:

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

4-{4-[2-(2-Methoxyphenyl)ethyl]-1-piperazinyl}-2-phenyl-6-{4-[(2E)-3-phenyl-2-propen-1-yl]-1-piperazinyl}pyrimidin [German] [ACD/IUPAC Name]
4-{4-[2-(2-Methoxyphenyl)ethyl]-1-piperazinyl}-2-phenyl-6-{4-[(2E)-3-phenyl-2-propen-1-yl]-1-piperazinyl}pyrimidine [ACD/IUPAC Name]
4-{4-[2-(2-Méthoxyphényl)éthyl]-1-pipérazinyl}-2-phényl-6-{4-[(2E)-3-phényl-2-propén-1-yl]-1-pipérazinyl}pyrimidine [French] [ACD/IUPAC Name]
Pyrimidine, 4-[4-[2-(2-methoxyphenyl)ethyl]-1-piperazinyl]-2-phenyl-6-[4-[(2E)-3-phenyl-2-propen-1-yl]-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 693.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.6±3.0 kJ/mol
Flash Point: 373.4±31.5 °C
Index of Refraction: 1.624
Molar Refractivity: 175.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.64
ACD/LogD (pH 5.5): 1.78
ACD/BCF (pH 5.5): 1.56
ACD/KOC (pH 5.5): 3.78
ACD/LogD (pH 7.4): 3.21
ACD/BCF (pH 7.4): 41.53
ACD/KOC (pH 7.4): 100.26
Polar Surface Area: 48 Å2
Polarizability: 69.5±0.5 10-24cm3
Surface Tension: 50.9±3.0 dyne/cm
Molar Volume: 496.5±3.0 cm3

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