ChemSpider 2D Image | N-[1-(Cyclohexylcarbonyl)-4-piperidinyl]-3-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide | C22H26F3N3O2S

N-[1-(Cyclohexylcarbonyl)-4-piperidinyl]-3-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide

  • Molecular FormulaC22H26F3N3O2S
  • Average mass453.521 Da
  • Monoisotopic mass453.169769 Da
  • ChemSpider ID33421216

More details:

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

N-[1-(Cyclohexylcarbonyl)-4-piperidinyl]-3-methyl-6-(trifluormethyl)thieno[2,3-b]pyridin-2-carboxamid [German] [ACD/IUPAC Name]
N-[1-(Cyclohexylcarbonyl)-4-piperidinyl]-3-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide [ACD/IUPAC Name]
N-[1-(Cyclohexylcarbonyl)-4-pipéridinyl]-3-méthyl-6-(trifluorométhyl)thiéno[2,3-b]pyridine-2-carboxamide [French] [ACD/IUPAC Name]
Thieno[2,3-b]pyridine-2-carboxamide, N-[1-(cyclohexylcarbonyl)-4-piperidinyl]-3-methyl-6-(trifluoromethyl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 615.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.3±3.0 kJ/mol
Flash Point: 326.1±31.5 °C
Index of Refraction: 1.589
Molar Refractivity: 113.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.07
ACD/LogD (pH 5.5): 4.11
ACD/BCF (pH 5.5): 784.77
ACD/KOC (pH 5.5): 4108.24
ACD/LogD (pH 7.4): 4.11
ACD/BCF (pH 7.4): 784.79
ACD/KOC (pH 7.4): 4108.32
Polar Surface Area: 91 Å2
Polarizability: 45.1±0.5 10-24cm3
Surface Tension: 53.4±5.0 dyne/cm
Molar Volume: 337.4±5.0 cm3

Click to predict properties on the Chemicalize site


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