ChemSpider 2D Image | 1-(3,4-Difluorobenzoyl)-N-(5-methyl-1,2-oxazol-3-yl)-L-prolinamide | C16H15F2N3O3

1-(3,4-Difluorobenzoyl)-N-(5-methyl-1,2-oxazol-3-yl)-L-prolinamide

  • Molecular FormulaC16H15F2N3O3
  • Average mass335.305 Da
  • Monoisotopic mass335.108154 Da
  • ChemSpider ID22885937

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-(3,4-Difluorbenzoyl)-N-(5-methyl-1,2-oxazol-3-yl)-L-prolinamid [German] [ACD/IUPAC Name]
1-(3,4-Difluorobenzoyl)-N-(5-methyl-1,2-oxazol-3-yl)-L-prolinamide [ACD/IUPAC Name]
1-(3,4-Difluorobenzoyl)-N-(5-méthyl-1,2-oxazol-3-yl)-L-prolinamide [French] [ACD/IUPAC Name]
2-Pyrrolidinecarboxamide, 1-(3,4-difluorobenzoyl)-N-(5-methyl-3-isoxazolyl)-, (2S)- [ACD/Index Name]
(2S)-1-(3,4-difluorobenzoyl)-N-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2-carboxamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 589.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.0±3.0 kJ/mol
Flash Point: 310.5±30.1 °C
Index of Refraction: 1.599
Molar Refractivity: 80.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.01
ACD/LogD (pH 5.5): 1.31
ACD/BCF (pH 5.5): 5.82
ACD/KOC (pH 5.5): 122.72
ACD/LogD (pH 7.4): 1.31
ACD/BCF (pH 7.4): 5.82
ACD/KOC (pH 7.4): 122.71
Polar Surface Area: 75 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 59.2±3.0 dyne/cm
Molar Volume: 236.1±3.0 cm3

Click to predict properties on the Chemicalize site


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