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

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

  • Molecular FormulaC17H17F2N5O3S
  • Average mass409.410 Da
  • Monoisotopic mass409.102020 Da
  • ChemSpider ID31155914

More details:

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

2-({4-Amino-5-[4-(difluormethoxy)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-furylmethyl)-N-methylacetamid [German] [ACD/IUPAC Name]
2-({4-Amino-5-[4-(difluoromethoxy)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-furylmethyl)-N-methylacetamide [ACD/IUPAC Name]
2-({4-Amino-5-[4-(difluorométhoxy)phényl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-furylméthyl)-N-méthylacétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[4-amino-5-[4-(difluoromethoxy)phenyl]-4H-1,2,4-triazol-3-yl]thio]-N-(2-furanylmethyl)-N-methyl- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 613.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.0±3.0 kJ/mol
Flash Point: 324.8±34.3 °C
Index of Refraction: 1.640
Molar Refractivity: 100.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.91
ACD/LogD (pH 5.5): 2.26
ACD/BCF (pH 5.5): 30.57
ACD/KOC (pH 5.5): 402.47
ACD/LogD (pH 7.4): 2.26
ACD/BCF (pH 7.4): 30.57
ACD/KOC (pH 7.4): 402.48
Polar Surface Area: 125 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 52.2±7.0 dyne/cm
Molar Volume: 278.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement