ChemSpider 2D Image | N-(4-Methyl-3-{[4-(3-pyridinyl)-2-pyrimidinyl]amino}phenyl)-4-(1-piperidinyl)-3-(trifluoromethyl)benzamide | C29H27F3N6O

N-(4-Methyl-3-{[4-(3-pyridinyl)-2-pyrimidinyl]amino}phenyl)-4-(1-piperidinyl)-3-(trifluoromethyl)benzamide

  • Molecular FormulaC29H27F3N6O
  • Average mass532.560 Da
  • Monoisotopic mass532.219849 Da
  • ChemSpider ID8522428

More details:






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

Benzamide, N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-4-(1-piperidinyl)-3-(trifluoromethyl)- [ACD/Index Name]
N-(4-Methyl-3-{[4-(3-pyridinyl)-2-pyrimidinyl]amino}phenyl)-4-(1-piperidinyl)-3-(trifluormethyl)benzamid [German] [ACD/IUPAC Name]
N-(4-Methyl-3-{[4-(3-pyridinyl)-2-pyrimidinyl]amino}phenyl)-4-(1-piperidinyl)-3-(trifluoromethyl)benzamide [ACD/IUPAC Name]
N-(4-Méthyl-3-{[4-(3-pyridinyl)-2-pyrimidinyl]amino}phényl)-4-(1-pipéridinyl)-3-(trifluorométhyl)benzamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.635
Molar Refractivity: 143.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.31
ACD/LogD (pH 5.5): 5.63
ACD/BCF (pH 5.5): 11124.09
ACD/KOC (pH 5.5): 27398.03
ACD/LogD (pH 7.4): 5.63
ACD/BCF (pH 7.4): 11140.61
ACD/KOC (pH 7.4): 27438.70
Polar Surface Area: 83 Å2
Polarizability: 57.0±0.5 10-24cm3
Surface Tension: 57.6±3.0 dyne/cm
Molar Volume: 401.4±3.0 cm3

Click to predict properties on the Chemicalize site






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