ChemSpider 2D Image | 2-{[4-Amino-5-(2-methyl-3-furyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(difluoromethoxy)phenyl]propanamide | C17H17F2N5O3S

2-{[4-Amino-5-(2-methyl-3-furyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(difluoromethoxy)phenyl]propanamide

  • Molecular FormulaC17H17F2N5O3S
  • Average mass409.410 Da
  • Monoisotopic mass409.102020 Da
  • ChemSpider ID31259207

More details:






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

2-{[4-Amino-5-(2-methyl-3-furyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(difluormethoxy)phenyl]propanamid [German] [ACD/IUPAC Name]
2-{[4-Amino-5-(2-methyl-3-furyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(difluoromethoxy)phenyl]propanamide [ACD/IUPAC Name]
2-{[4-Amino-5-(2-méthyl-3-furyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(difluorométhoxy)phényl]propanamide [French] [ACD/IUPAC Name]
Propanamide, 2-[[4-amino-5-(2-methyl-3-furanyl)-4H-1,2,4-triazol-3-yl]thio]-N-[4-(difluoromethoxy)phenyl]- [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: 1.652
Molar Refractivity: 99.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.52
ACD/LogD (pH 5.5): 2.38
ACD/BCF (pH 5.5): 37.75
ACD/KOC (pH 5.5): 468.15
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 37.75
ACD/KOC (pH 7.4): 468.16
Polar Surface Area: 134 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 51.3±7.0 dyne/cm
Molar Volume: 271.2±7.0 cm3

Click to predict properties on the Chemicalize site






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