ChemSpider 2D Image | 2-({4-[2-Oxo-2-({1-[3-(trifluoromethyl)benzyl]-1H-benzimidazol-2-yl}amino)ethyl]-1,3-thiazol-2-yl}sulfanyl)propanamide | C23H20F3N5O2S2

2-({4-[2-Oxo-2-({1-[3-(trifluoromethyl)benzyl]-1H-benzimidazol-2-yl}amino)ethyl]-1,3-thiazol-2-yl}sulfanyl)propanamide

  • Molecular FormulaC23H20F3N5O2S2
  • Average mass519.562 Da
  • Monoisotopic mass519.101074 Da
  • ChemSpider ID128667399

More details:

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

2-({4-[2-Oxo-2-({1-[3-(trifluormethyl)benzyl]-1H-benzimidazol-2-yl}amino)ethyl]-1,3-thiazol-2-yl}sulfanyl)propanamid [German] [ACD/IUPAC Name]
2-({4-[2-Oxo-2-({1-[3-(trifluoromethyl)benzyl]-1H-benzimidazol-2-yl}amino)ethyl]-1,3-thiazol-2-yl}sulfanyl)propanamide [ACD/IUPAC Name]
2-({4-[2-Oxo-2-({1-[3-(trifluorométhyl)benzyl]-1H-benzimidazol-2-yl}amino)éthyl]-1,3-thiazol-2-yl}sulfanyl)propanamide [French] [ACD/IUPAC Name]
4-Thiazoleacetamide, 2-[(2-amino-1-methyl-2-oxoethyl)thio]-N-[1-[[3-(trifluoromethyl)phenyl]methyl]-1H-benzimidazol-2-yl]- [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.677
Molar Refractivity: 130.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.86
ACD/LogD (pH 5.5): 4.21
ACD/BCF (pH 5.5): 915.72
ACD/KOC (pH 5.5): 4463.21
ACD/LogD (pH 7.4): 4.26
ACD/BCF (pH 7.4): 1007.80
ACD/KOC (pH 7.4): 4911.98
Polar Surface Area: 156 Å2
Polarizability: 51.8±0.5 10-24cm3
Surface Tension: 54.4±7.0 dyne/cm
Molar Volume: 346.8±7.0 cm3

Click to predict properties on the Chemicalize site


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