ChemSpider 2D Image | 1-({5-[(2,6-Difluorophenoxy)methyl]-1,2-oxazol-3-yl}carbonyl)-N-ethyl-L-prolinamide | C18H19F2N3O4

1-({5-[(2,6-Difluorophenoxy)methyl]-1,2-oxazol-3-yl}carbonyl)-N-ethyl-L-prolinamide

  • Molecular FormulaC18H19F2N3O4
  • Average mass379.358 Da
  • Monoisotopic mass379.134369 Da
  • ChemSpider ID29578606

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-({5-[(2,6-Difluorophenoxy)methyl]-1,2-oxazol-3-yl}carbonyl)-N-ethyl-L-prolinamide [ACD/IUPAC Name]
1-({5-[(2,6-Difluorophénoxy)méthyl]-1,2-oxazol-3-yl}carbonyl)-N-éthyl-L-prolinamide [French] [ACD/IUPAC Name]
1-({5-[(2,6-Difluorphenoxy)methyl]-1,2-oxazol-3-yl}carbonyl)-N-ethyl-L-prolinamid [German] [ACD/IUPAC Name]
2-Pyrrolidinecarboxamide, 1-[[5-[(2,6-difluorophenoxy)methyl]-3-isoxazolyl]carbonyl]-N-ethyl-, (2S)- [ACD/Index Name]
(2S)-1-({5-[(2,6-difluorophenoxy)methyl]isoxazol-3-yl}carbonyl)-N-ethylpyrrolidine-2-carboxamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 636.6±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: 338.8±31.5 °C
Index of Refraction: 1.555
Molar Refractivity: 90.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.82
ACD/LogD (pH 5.5): 0.92
ACD/BCF (pH 5.5): 2.93
ACD/KOC (pH 5.5): 75.16
ACD/LogD (pH 7.4): 0.92
ACD/BCF (pH 7.4): 2.93
ACD/KOC (pH 7.4): 75.16
Polar Surface Area: 85 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 51.2±3.0 dyne/cm
Molar Volume: 282.5±3.0 cm3

Click to predict properties on the Chemicalize site


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