ChemSpider 2D Image | N-[4-Methyl-3-({1-[6-(3-pyridinylamino)-4-pyrimidinyl]-1H-imidazol-2-yl}amino)phenyl]-3-(trifluoromethyl)benzamide | C27H21F3N8O

N-[4-Methyl-3-({1-[6-(3-pyridinylamino)-4-pyrimidinyl]-1H-imidazol-2-yl}amino)phenyl]-3-(trifluoromethyl)benzamide

  • Molecular FormulaC27H21F3N8O
  • Average mass530.504 Da
  • Monoisotopic mass530.179016 Da
  • ChemSpider ID9701386

More details:

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

Benzamide, N-[4-methyl-3-[[1-[6-(3-pyridinylamino)-4-pyrimidinyl]-1H-imidazol-2-yl]amino]phenyl]-3-(trifluoromethyl)- [ACD/Index Name]
N-[4-Methyl-3-({1-[6-(3-pyridinylamino)-4-pyrimidinyl]-1H-imidazol-2-yl}amino)phenyl]-3-(trifluormethyl)benzamid [German] [ACD/IUPAC Name]
N-[4-Methyl-3-({1-[6-(3-pyridinylamino)-4-pyrimidinyl]-1H-imidazol-2-yl}amino)phenyl]-3-(trifluoromethyl)benzamide [ACD/IUPAC Name]
N-[4-Méthyl-3-({1-[6-(3-pyridinylamino)-4-pyrimidinyl]-1H-imidazol-2-yl}amino)phényl]-3-(trifluorométhyl)benzamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.665
Molar Refractivity: 140.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 4.37
ACD/BCF (pH 5.5): 1185.00
ACD/KOC (pH 5.5): 5280.04
ACD/LogD (pH 7.4): 4.43
ACD/BCF (pH 7.4): 1380.73
ACD/KOC (pH 7.4): 6152.20
Polar Surface Area: 110 Å2
Polarizability: 55.7±0.5 10-24cm3
Surface Tension: 50.6±7.0 dyne/cm
Molar Volume: 378.2±7.0 cm3

Click to predict properties on the Chemicalize site


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