ChemSpider 2D Image | N-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-isobutyl-2-[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetamide | C18H22F3N3O3S

N-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-isobutyl-2-[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetamide

  • Molecular FormulaC18H22F3N3O3S
  • Average mass417.446 Da
  • Monoisotopic mass417.133392 Da
  • ChemSpider ID21987949

More details:

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

1H-Benzimidazole-1-acetamide, N-(2-methylpropyl)-N-(tetrahydro-1,1-dioxido-3-thienyl)-2-(trifluoromethyl)- [ACD/Index Name]
N-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-isobutyl-2-[2-(trifluormethyl)-1H-benzimidazol-1-yl]acetamid [German] [ACD/IUPAC Name]
N-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-isobutyl-2-[2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetamide [ACD/IUPAC Name]
N-(1,1-Dioxydotétrahydro-3-thiophényl)-N-isobutyl-2-[2-(trifluorométhyl)-1H-benzimidazol-1-yl]acétamide [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: 580.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.8±3.0 kJ/mol
Flash Point: 304.7±30.1 °C
Index of Refraction: 1.593
Molar Refractivity: 99.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.18
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 16.09
ACD/KOC (pH 5.5): 254.23
ACD/LogD (pH 7.4): 1.89
ACD/BCF (pH 7.4): 16.09
ACD/KOC (pH 7.4): 254.29
Polar Surface Area: 81 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 45.4±7.0 dyne/cm
Molar Volume: 292.9±7.0 cm3

Click to predict properties on the Chemicalize site


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