ChemSpider 2D Image | N-Benzyl-N-methyl-2-({(tetrahydro-2-thiophenylmethyl)[3-(trifluoromethyl)benzyl]amino}methyl)-1,3-oxazolidine-4-carboxamide | C26H32F3N3O2S

N-Benzyl-N-methyl-2-({(tetrahydro-2-thiophenylmethyl)[3-(trifluoromethyl)benzyl]amino}methyl)-1,3-oxazolidine-4-carboxamide

  • Molecular FormulaC26H32F3N3O2S
  • Average mass507.611 Da
  • Monoisotopic mass507.216736 Da
  • ChemSpider ID110128332

More details:

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

4-Oxazolidinecarboxamide, N-methyl-N-(phenylmethyl)-2-[[[(tetrahydro-2-thienyl)methyl][[3-(trifluoromethyl)phenyl]methyl]amino]methyl]- [ACD/Index Name]
N-Benzyl-N-methyl-2-({(tetrahydro-2-thiophenylmethyl)[3-(trifluormethyl)benzyl]amino}methyl)-1,3-oxazolidin-4-carboxamid [German] [ACD/IUPAC Name]
N-Benzyl-N-methyl-2-({(tetrahydro-2-thiophenylmethyl)[3-(trifluoromethyl)benzyl]amino}methyl)-1,3-oxazolidine-4-carboxamide [ACD/IUPAC Name]
N-Benzyl-N-méthyl-2-({(tétrahydro-2-thiophénylméthyl)[3-(trifluorométhyl)benzyl]amino}méthyl)-1,3-oxazolidine-4-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 611.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.8±3.0 kJ/mol
Flash Point: 323.8±31.5 °C
Index of Refraction: 1.558
Molar Refractivity: 132.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 3.98
ACD/LogD (pH 5.5): 3.13
ACD/BCF (pH 5.5): 74.00
ACD/KOC (pH 5.5): 352.89
ACD/LogD (pH 7.4): 4.23
ACD/BCF (pH 7.4): 938.05
ACD/KOC (pH 7.4): 4473.54
Polar Surface Area: 70 Å2
Polarizability: 52.6±0.5 10-24cm3
Surface Tension: 43.2±3.0 dyne/cm
Molar Volume: 411.3±3.0 cm3

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