ChemSpider 2D Image | 5-Methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl]-4-{[4-(3-pyridinyl)-2-pyrimidinyl]amino}-2-pyridinecarboxamide | C27H21F3N8O

5-Methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl]-4-{[4-(3-pyridinyl)-2-pyrimidinyl]amino}-2-pyridinecarboxamide

  • Molecular FormulaC27H21F3N8O
  • Average mass530.504 Da
  • Monoisotopic mass530.179016 Da
  • ChemSpider ID10130819

More details:

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

2-Pyridinecarboxamide, 5-methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl]-4-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]- [ACD/Index Name]
5-Methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifluormethyl)phenyl]-4-{[4-(3-pyridinyl)-2-pyrimidinyl]amino}-2-pyridincarboxamid [German] [ACD/IUPAC Name]
5-Methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl]-4-{[4-(3-pyridinyl)-2-pyrimidinyl]amino}-2-pyridinecarboxamide [ACD/IUPAC Name]
5-Méthyl-N-[3-(4-méthyl-1H-imidazol-1-yl)-5-(trifluorométhyl)phényl]-4-{[4-(3-pyridinyl)-2-pyrimidinyl]amino}-2-pyridinecarboxamide [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: 140.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.05
ACD/LogD (pH 5.5): 3.40
ACD/BCF (pH 5.5): 183.64
ACD/KOC (pH 5.5): 1128.64
ACD/LogD (pH 7.4): 3.78
ACD/BCF (pH 7.4): 438.19
ACD/KOC (pH 7.4): 2693.11
Polar Surface Area: 111 Å2
Polarizability: 55.6±0.5 10-24cm3
Surface Tension: 49.6±7.0 dyne/cm
Molar Volume: 377.3±7.0 cm3

Click to predict properties on the Chemicalize site


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