ChemSpider 2D Image | 4-[(4-{[3-(Trifluoromethyl)phenyl]amino}-2-pyrimidinyl)amino]benzamide | C18H14F3N5O

4-[(4-{[3-(Trifluoromethyl)phenyl]amino}-2-pyrimidinyl)amino]benzamide

  • Molecular FormulaC18H14F3N5O
  • Average mass373.332 Da
  • Monoisotopic mass373.115051 Da
  • ChemSpider ID35034129

More details:

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

4-[(4-{[3-(Trifluormethyl)phenyl]amino}-2-pyrimidinyl)amino]benzamid [German] [ACD/IUPAC Name]
4-[(4-{[3-(Trifluoromethyl)phenyl]amino}-2-pyrimidinyl)amino]benzamide [ACD/IUPAC Name]
4-[(4-{[3-(Trifluorométhyl)phényl]amino}-2-pyrimidinyl)amino]benzamide [French] [ACD/IUPAC Name]
4-[(4-{[3-(Trifluoromethyl)phenyl]amino}pyrimidin-2-Yl)amino]benzamide
Benzamide, 4-[[4-[[3-(trifluoromethyl)phenyl]amino]-2-pyrimidinyl]amino]- [ACD/Index Name]
NHJ

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

Density: 1.4±0.1 g/cm3
Boiling Point: 572.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.8±3.0 kJ/mol
Flash Point: 300.2±32.9 °C
Index of Refraction: 1.652
Molar Refractivity: 95.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.84
ACD/LogD (pH 5.5): 3.18
ACD/BCF (pH 5.5): 140.78
ACD/KOC (pH 5.5): 1087.65
ACD/LogD (pH 7.4): 3.33
ACD/BCF (pH 7.4): 198.49
ACD/KOC (pH 7.4): 1533.46
Polar Surface Area: 93 Å2
Polarizability: 37.7±0.5 10-24cm3
Surface Tension: 56.7±3.0 dyne/cm
Molar Volume: 260.2±3.0 cm3

Click to predict properties on the Chemicalize site


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