ChemSpider 2D Image | N~3~-[(3,4-Difluorophenyl)sulfonyl]-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]-beta-alaninamide | C17H17F2N5O3S

N3-[(3,4-Difluorophenyl)sulfonyl]-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]-β-alaninamide

  • Molecular FormulaC17H17F2N5O3S
  • Average mass409.410 Da
  • Monoisotopic mass409.102020 Da
  • ChemSpider ID21643664

More details:






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

N3-[(3,4-Difluorophenyl)sulfonyl]-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]-β-alaninamide [ACD/IUPAC Name]
N3-[(3,4-Difluorophényl)sulfonyl]-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)éthyl]-β-alaninamide [French] [ACD/IUPAC Name]
N3-[(3,4-Difluorphenyl)sulfonyl]-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]-β-alaninamid [German] [ACD/IUPAC Name]
Propanamide, 3-[[(3,4-difluorophenyl)sulfonyl]amino]-N-[2-(1,2,4-triazolo[4,3-a]pyridin-3-yl)ethyl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.650
Molar Refractivity: 99.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.69
ACD/LogD (pH 5.5): 1.26
ACD/BCF (pH 5.5): 5.33
ACD/KOC (pH 5.5): 114.93
ACD/LogD (pH 7.4): 1.26
ACD/BCF (pH 7.4): 5.37
ACD/KOC (pH 7.4): 115.87
Polar Surface Area: 114 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 55.4±7.0 dyne/cm
Molar Volume: 273.6±7.0 cm3

Click to predict properties on the Chemicalize site






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