ChemSpider 2D Image | 2-{4-[(1,1-Dioxidotetrahydro-3-thiophenyl)amino]-1-piperidinyl}-N-[2-(trifluoromethoxy)benzyl]acetamide | C19H26F3N3O4S

2-{4-[(1,1-Dioxidotetrahydro-3-thiophenyl)amino]-1-piperidinyl}-N-[2-(trifluoromethoxy)benzyl]acetamide

  • Molecular FormulaC19H26F3N3O4S
  • Average mass449.488 Da
  • Monoisotopic mass449.159607 Da
  • ChemSpider ID30270068

More details:

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

1-Piperidineacetamide, 4-[(tetrahydro-1,1-dioxido-3-thienyl)amino]-N-[[2-(trifluoromethoxy)phenyl]methyl]- [ACD/Index Name]
2-{4-[(1,1-Dioxidotetrahydro-3-thiophenyl)amino]-1-piperidinyl}-N-[2-(trifluormethoxy)benzyl]acetamid [German] [ACD/IUPAC Name]
2-{4-[(1,1-Dioxidotetrahydro-3-thiophenyl)amino]-1-piperidinyl}-N-[2-(trifluoromethoxy)benzyl]acetamide [ACD/IUPAC Name]
2-{4-[(1,1-Dioxydotétrahydro-3-thiophényl)amino]-1-pipéridinyl}-N-[2-(trifluorométhoxy)benzyl]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: 623.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.4±3.0 kJ/mol
Flash Point: 330.9±31.5 °C
Index of Refraction: 1.559
Molar Refractivity: 105.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.91
ACD/LogD (pH 5.5): -0.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.36
ACD/LogD (pH 7.4): 0.86
ACD/BCF (pH 7.4): 2.34
ACD/KOC (pH 7.4): 55.27
Polar Surface Area: 96 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 51.5±5.0 dyne/cm
Molar Volume: 325.2±5.0 cm3

Click to predict properties on the Chemicalize site


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