ChemSpider 2D Image | 2-{1-[(4-{[5-(3-Fluorophenoxy)-2-pyridinyl]carbonyl}-2-morpholinyl)methyl]-1H-1,2,3-triazol-4-yl}ethyl carbamate | C22H23FN6O5

2-{1-[(4-{[5-(3-Fluorophenoxy)-2-pyridinyl]carbonyl}-2-morpholinyl)methyl]-1H-1,2,3-triazol-4-yl}ethyl carbamate

  • Molecular FormulaC22H23FN6O5
  • Average mass470.454 Da
  • Monoisotopic mass470.171387 Da
  • ChemSpider ID103782039

More details:

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

2-{1-[(4-{[5-(3-Fluorophenoxy)-2-pyridinyl]carbonyl}-2-morpholinyl)methyl]-1H-1,2,3-triazol-4-yl}ethyl carbamate [ACD/IUPAC Name]
2-{1-[(4-{[5-(3-Fluorphenoxy)-2-pyridinyl]carbonyl}-2-morpholinyl)methyl]-1H-1,2,3-triazol-4-yl}ethylcarbamat [German] [ACD/IUPAC Name]
Carbamate de 2-{1-[(4-{[5-(3-fluorophénoxy)-2-pyridinyl]carbonyl}-2-morpholinyl)méthyl]-1H-1,2,3-triazol-4-yl}éthyle [French] [ACD/IUPAC Name]
Methanone, [2-[[4-[2-[(aminocarbonyl)oxy]ethyl]-1H-1,2,3-triazol-1-yl]methyl]-4-morpholinyl][5-(3-fluorophenoxy)-2-pyridinyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 738.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.8±3.0 kJ/mol
Flash Point: 400.5±35.7 °C
Index of Refraction: 1.658
Molar Refractivity: 118.5±0.5 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 1.01
ACD/LogD (pH 5.5): 1.12
ACD/BCF (pH 5.5): 4.19
ACD/KOC (pH 5.5): 97.01
ACD/LogD (pH 7.4): 1.12
ACD/BCF (pH 7.4): 4.19
ACD/KOC (pH 7.4): 97.03
Polar Surface Area: 135 Å2
Polarizability: 47.0±0.5 10-24cm3
Surface Tension: 58.1±7.0 dyne/cm
Molar Volume: 321.7±7.0 cm3

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