ChemSpider 2D Image | 2-Methyl-2-propanyl 4-[4-({8-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl][1,2,4]triazolo[1,5-a]pyridin-2-yl}amino)phenyl]-1-piperidinecarboxylate | C29H31F3N6O3

2-Methyl-2-propanyl 4-[4-({8-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl][1,2,4]triazolo[1,5-a]pyridin-2-yl}amino)phenyl]-1-piperidinecarboxylate

  • Molecular FormulaC29H31F3N6O3
  • Average mass568.590 Da
  • Monoisotopic mass568.240967 Da
  • ChemSpider ID34952104

More details:

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

1-Piperidinecarboxylic acid, 4-[4-[[8-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl][1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-[4-({8-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl][1,2,4]triazolo[1,5-a]pyridin-2-yl}amino)phenyl]-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-[4-({8-[2-methoxy-5-(trifluormethyl)-3-pyridinyl][1,2,4]triazolo[1,5-a]pyridin-2-yl}amino)phenyl]-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-[4-({8-[2-Méthoxy-5-(trifluorométhyl)-3-pyridinyl][1,2,4]triazolo[1,5-a]pyridin-2-yl}amino)phényl]-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
US8501936, 277

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.613
Molar Refractivity: 147.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.74
ACD/LogD (pH 5.5): 6.06
ACD/BCF (pH 5.5): 23716.78
ACD/KOC (pH 5.5): 47095.08
ACD/LogD (pH 7.4): 6.06
ACD/BCF (pH 7.4): 23769.03
ACD/KOC (pH 7.4): 47198.82
Polar Surface Area: 94 Å2
Polarizability: 58.3±0.5 10-24cm3
Surface Tension: 44.5±7.0 dyne/cm
Molar Volume: 422.6±7.0 cm3

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