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

N-(1-Phenylethyl)-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 ID110128318

More details:

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

4-Oxazolidinecarboxamide, N-(1-phenylethyl)-2-[[[(tetrahydro-2-thienyl)methyl][[3-(trifluoromethyl)phenyl]methyl]amino]methyl]- [ACD/Index Name]
N-(1-Phenylethyl)-2-({(tetrahydro-2-thiophenylmethyl)[3-(trifluormethyl)benzyl]amino}methyl)-1,3-oxazolidin-4-carboxamid [German] [ACD/IUPAC Name]
N-(1-Phenylethyl)-2-({(tetrahydro-2-thiophenylmethyl)[3-(trifluoromethyl)benzyl]amino}methyl)-1,3-oxazolidine-4-carboxamide [ACD/IUPAC Name]
N-(1-Phényléthyl)-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: 637.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.1±3.0 kJ/mol
Flash Point: 339.1±31.5 °C
Index of Refraction: 1.554
Molar Refractivity: 132.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.04
ACD/LogD (pH 5.5): 3.20
ACD/BCF (pH 5.5): 82.55
ACD/KOC (pH 5.5): 378.21
ACD/LogD (pH 7.4): 4.31
ACD/BCF (pH 7.4): 1079.69
ACD/KOC (pH 7.4): 4946.48
Polar Surface Area: 79 Å2
Polarizability: 52.5±0.5 10-24cm3
Surface Tension: 42.2±3.0 dyne/cm
Molar Volume: 413.6±3.0 cm3

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