ChemSpider 2D Image | N-(1,3-Benzodioxol-5-ylmethyl)-2-(3-{[3-(trifluoromethyl)benzyl]oxy}phenyl)-1,3-thiazole-4-carboxamide | C26H19F3N2O4S

N-(1,3-Benzodioxol-5-ylmethyl)-2-(3-{[3-(trifluoromethyl)benzyl]oxy}phenyl)-1,3-thiazole-4-carboxamide

  • Molecular FormulaC26H19F3N2O4S
  • Average mass512.500 Da
  • Monoisotopic mass512.101746 Da
  • ChemSpider ID22719944

More details:

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

4-Thiazolecarboxamide, N-(1,3-benzodioxol-5-ylmethyl)-2-[3-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]- [ACD/Index Name]
N-(1,3-Benzodioxol-5-ylmethyl)-2-(3-{[3-(trifluormethyl)benzyl]oxy}phenyl)-1,3-thiazol-4-carboxamid [German] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylmethyl)-2-(3-{[3-(trifluoromethyl)benzyl]oxy}phenyl)-1,3-thiazole-4-carboxamide [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylméthyl)-2-(3-{[3-(trifluorométhyl)benzyl]oxy}phényl)-1,3-thiazole-4-carboxamide [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: 1.611
Molar Refractivity: 127.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.22
ACD/LogD (pH 5.5): 5.12
ACD/BCF (pH 5.5): 4602.45
ACD/KOC (pH 5.5): 14573.37
ACD/LogD (pH 7.4): 5.12
ACD/BCF (pH 7.4): 4601.51
ACD/KOC (pH 7.4): 14570.39
Polar Surface Area: 98 Å2
Polarizability: 50.6±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 367.9±3.0 cm3

Click to predict properties on the Chemicalize site


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