ChemSpider 2D Image | 2-(4-Chlorophenyl)-4-[(2-fluorophenyl)sulfonyl]-N-[2-(4-morpholinyl)-2-(2-thienyl)ethyl]-1,3-oxazol-5-amine | C25H23ClFN3O4S2

2-(4-Chlorophenyl)-4-[(2-fluorophenyl)sulfonyl]-N-[2-(4-morpholinyl)-2-(2-thienyl)ethyl]-1,3-oxazol-5-amine

  • Molecular FormulaC25H23ClFN3O4S2
  • Average mass548.049 Da
  • Monoisotopic mass547.080261 Da
  • ChemSpider ID127402339

More details:

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

2-(4-Chlorophenyl)-4-[(2-fluorophenyl)sulfonyl]-N-[2-(4-morpholinyl)-2-(2-thienyl)ethyl]-1,3-oxazol-5-amine [ACD/IUPAC Name]
2-(4-Chlorophényl)-4-[(2-fluorophényl)sulfonyl]-N-[2-(4-morpholinyl)-2-(2-thiényl)éthyl]-1,3-oxazol-5-amine [French] [ACD/IUPAC Name]
2-(4-Chlorphenyl)-4-[(2-fluorphenyl)sulfonyl]-N-[2-(4-morpholinyl)-2-(2-thienyl)ethyl]-1,3-oxazol-5-amin [German] [ACD/IUPAC Name]
4-Morpholineethanamine, N-[2-(4-chlorophenyl)-4-[(2-fluorophenyl)sulfonyl]-5-oxazolyl]-β-2-thienyl- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 749.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.2±3.0 kJ/mol
Flash Point: 406.8±35.7 °C
Index of Refraction: 1.640
Molar Refractivity: 138.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.02
ACD/LogD (pH 5.5): 4.35
ACD/BCF (pH 5.5): 1109.17
ACD/KOC (pH 5.5): 4874.05
ACD/LogD (pH 7.4): 4.46
ACD/BCF (pH 7.4): 1447.25
ACD/KOC (pH 7.4): 6359.67
Polar Surface Area: 121 Å2
Polarizability: 54.7±0.5 10-24cm3
Surface Tension: 59.7±3.0 dyne/cm
Molar Volume: 383.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement