ChemSpider 2D Image | 2-[(5-Fluoro-3-pyridinyl)methyl]-6-[2-(2,2,2-trifluoroethoxy)-5-pyrimidinyl]-3(2H)-pyridazinone | C16H11F4N5O2

2-[(5-Fluoro-3-pyridinyl)methyl]-6-[2-(2,2,2-trifluoroethoxy)-5-pyrimidinyl]-3(2H)-pyridazinone

  • Molecular FormulaC16H11F4N5O2
  • Average mass381.284 Da
  • Monoisotopic mass381.084900 Da
  • ChemSpider ID128921511

More details:

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

2-[(5-Fluor-3-pyridinyl)methyl]-6-[2-(2,2,2-trifluorethoxy)-5-pyrimidinyl]-3(2H)-pyridazinon [German] [ACD/IUPAC Name]
2-[(5-Fluoro-3-pyridinyl)methyl]-6-[2-(2,2,2-trifluoroethoxy)-5-pyrimidinyl]-3(2H)-pyridazinone [ACD/IUPAC Name]
2-[(5-Fluoro-3-pyridinyl)méthyl]-6-[2-(2,2,2-trifluoroéthoxy)-5-pyrimidinyl]-3(2H)-pyridazinone [French] [ACD/IUPAC Name]
3(2H)-Pyridazinone, 2-[(5-fluoro-3-pyridinyl)methyl]-6-[2-(2,2,2-trifluoroethoxy)-5-pyrimidinyl]- [ACD/Index Name]
2417395-15-2 [RN]
Sevasemten

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

Density: 1.5±0.1 g/cm3
Boiling Point: 498.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 255.0±31.5 °C
Index of Refraction: 1.599
Molar Refractivity: 87.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.37
ACD/LogD (pH 5.5): 0.79
ACD/BCF (pH 5.5): 2.36
ACD/KOC (pH 5.5): 64.28
ACD/LogD (pH 7.4): 0.79
ACD/BCF (pH 7.4): 2.36
ACD/KOC (pH 7.4): 64.32
Polar Surface Area: 81 Å2
Polarizability: 34.5±0.5 10-24cm3
Surface Tension: 45.3±7.0 dyne/cm
Molar Volume: 254.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement