ChemSpider 2D Image | 4-[4-(Diphenylmethyl)-1-piperazinyl]-6-(4-methyl-3-phenyl-1-piperazinyl)-2-[4-(2-methyl-2-propanyl)phenyl]pyrimidine | C42H48N6

4-[4-(Diphenylmethyl)-1-piperazinyl]-6-(4-methyl-3-phenyl-1-piperazinyl)-2-[4-(2-methyl-2-propanyl)phenyl]pyrimidine

  • Molecular FormulaC42H48N6
  • Average mass636.871 Da
  • Monoisotopic mass636.394043 Da
  • ChemSpider ID122017612

More details:

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

4-[4-(Diphenylmethyl)-1-piperazinyl]-6-(4-methyl-3-phenyl-1-piperazinyl)-2-[4-(2-methyl-2-propanyl)phenyl]pyrimidin [German] [ACD/IUPAC Name]
4-[4-(Diphenylmethyl)-1-piperazinyl]-6-(4-methyl-3-phenyl-1-piperazinyl)-2-[4-(2-methyl-2-propanyl)phenyl]pyrimidine [ACD/IUPAC Name]
4-[4-(Diphénylméthyl)-1-pipérazinyl]-6-(4-méthyl-3-phényl-1-pipérazinyl)-2-[4-(2-méthyl-2-propanyl)phényl]pyrimidine [French] [ACD/IUPAC Name]
Pyrimidine, 2-[4-(1,1-dimethylethyl)phenyl]-4-[4-(diphenylmethyl)-1-piperazinyl]-6-(4-methyl-3-phenyl-1-piperazinyl)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 701.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.6±3.0 kJ/mol
Flash Point: 377.8±32.9 °C
Index of Refraction: 1.615
Molar Refractivity: 195.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 7.80
ACD/LogD (pH 5.5): 4.53
ACD/BCF (pH 5.5): 305.68
ACD/KOC (pH 5.5): 290.60
ACD/LogD (pH 7.4): 5.08
ACD/BCF (pH 7.4): 1107.17
ACD/KOC (pH 7.4): 1052.56
Polar Surface Area: 39 Å2
Polarizability: 77.6±0.5 10-24cm3
Surface Tension: 49.1±3.0 dyne/cm
Molar Volume: 560.8±3.0 cm3

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