ChemSpider 2D Image | 2,6-Dichloro-4-{[6-(3,5-dimethyl-4-phenyl-1-piperazinyl)-2-phenyl-4-pyrimidinyl]amino}phenol | C28H27Cl2N5O

2,6-Dichloro-4-{[6-(3,5-dimethyl-4-phenyl-1-piperazinyl)-2-phenyl-4-pyrimidinyl]amino}phenol

  • Molecular FormulaC28H27Cl2N5O
  • Average mass520.453 Da
  • Monoisotopic mass519.159241 Da
  • ChemSpider ID121495213

More details:

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

2,6-Dichlor-4-{[6-(3,5-dimethyl-4-phenyl-1-piperazinyl)-2-phenyl-4-pyrimidinyl]amino}phenol [German] [ACD/IUPAC Name]
2,6-Dichloro-4-{[6-(3,5-dimethyl-4-phenyl-1-piperazinyl)-2-phenyl-4-pyrimidinyl]amino}phenol [ACD/IUPAC Name]
2,6-Dichloro-4-{[6-(3,5-diméthyl-4-phényl-1-pipérazinyl)-2-phényl-4-pyrimidinyl]amino}phénol [French] [ACD/IUPAC Name]
Phenol, 2,6-dichloro-4-[[6-(3,5-dimethyl-4-phenyl-1-piperazinyl)-2-phenyl-4-pyrimidinyl]amino]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 590.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.3±3.0 kJ/mol
Flash Point: 310.8±30.1 °C
Index of Refraction: 1.655
Molar Refractivity: 145.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 6.75
ACD/LogD (pH 5.5): 5.06
ACD/BCF (pH 5.5): 1704.26
ACD/KOC (pH 5.5): 2499.90
ACD/LogD (pH 7.4): 5.81
ACD/BCF (pH 7.4): 9541.49
ACD/KOC (pH 7.4): 13995.95
Polar Surface Area: 65 Å2
Polarizability: 57.8±0.5 10-24cm3
Surface Tension: 56.8±3.0 dyne/cm
Molar Volume: 397.0±3.0 cm3

Click to predict properties on the Chemicalize site


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