ChemSpider 2D Image | 2-[5,7-Dimethyl-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[2-(1H-1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]acetamide | C19H17F3N8OS

2-[5,7-Dimethyl-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[2-(1H-1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]acetamide

  • Molecular FormulaC19H17F3N8OS
  • Average mass462.452 Da
  • Monoisotopic mass462.119812 Da
  • ChemSpider ID22573883

More details:

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

[1,2,4]Triazolo[1,5-a]pyrimidine-6-acetamide, 5,7-dimethyl-2-(methylthio)-N-[2-(1H-1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]- [ACD/Index Name]
2-[5,7-Dimethyl-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[2-(1H-1,2,4-triazol-1-yl)-5-(trifluormethyl)phenyl]acetamid [German] [ACD/IUPAC Name]
2-[5,7-Dimethyl-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[2-(1H-1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]acetamide [ACD/IUPAC Name]
2-[5,7-Diméthyl-2-(méthylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-[2-(1H-1,2,4-triazol-1-yl)-5-(trifluorométhyl)phényl]acétamide [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.696
Molar Refractivity: 114.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): 2.27
ACD/BCF (pH 5.5): 31.18
ACD/KOC (pH 5.5): 408.27
ACD/LogD (pH 7.4): 2.27
ACD/BCF (pH 7.4): 31.19
ACD/KOC (pH 7.4): 408.32
Polar Surface Area: 128 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 297.2±7.0 cm3

Click to predict properties on the Chemicalize site


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