ChemSpider 2D Image | N-{2-[(2,3-Dimethylphenyl)amino]-2-oxoethyl}-3-[5,7-dimethyl-2-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide | C21H23F3N6O2

N-{2-[(2,3-Dimethylphenyl)amino]-2-oxoethyl}-3-[5,7-dimethyl-2-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide

  • Molecular FormulaC21H23F3N6O2
  • Average mass448.441 Da
  • Monoisotopic mass448.183472 Da
  • ChemSpider ID30605912

More details:

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

[1,2,4]Triazolo[1,5-a]pyrimidine-6-propanamide, N-[2-[(2,3-dimethylphenyl)amino]-2-oxoethyl]-5,7-dimethyl-2-(trifluoromethyl)- [ACD/Index Name]
N-{2-[(2,3-Dimethylphenyl)amino]-2-oxoethyl}-3-[5,7-dimethyl-2-(trifluormethyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamid [German] [ACD/IUPAC Name]
N-{2-[(2,3-Dimethylphenyl)amino]-2-oxoethyl}-3-[5,7-dimethyl-2-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide [ACD/IUPAC Name]
N-{2-[(2,3-Diméthylphényl)amino]-2-oxoéthyl}-3-[5,7-diméthyl-2-(trifluorométhyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide [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: 1.607
Molar Refractivity: 112.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.29
ACD/LogD (pH 5.5): 2.28
ACD/BCF (pH 5.5): 31.63
ACD/KOC (pH 5.5): 412.46
ACD/LogD (pH 7.4): 2.28
ACD/BCF (pH 7.4): 31.63
ACD/KOC (pH 7.4): 412.47
Polar Surface Area: 101 Å2
Polarizability: 44.4±0.5 10-24cm3
Surface Tension: 43.0±7.0 dyne/cm
Molar Volume: 324.3±7.0 cm3

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