Found 92 results

Search term: MF = 'C_{19}H_{22}FN_{7}O_{2}'
ChemSpider 2D Image | [1-(2-Aminoethyl)-1H-1,2,3-triazol-4-yl]{2-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-1-azepanyl}methanone | C19H22FN7O2

[1-(2-Aminoethyl)-1H-1,2,3-triazol-4-yl]{2-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-1-azepanyl}methanone

  • Molecular FormulaC19H22FN7O2
  • Average mass399.422 Da
  • Monoisotopic mass399.181915 Da
  • ChemSpider ID64999921

More details:

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

[1-(2-Aminoethyl)-1H-1,2,3-triazol-4-yl]{2-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-1-azepanyl}methanone [ACD/IUPAC Name]
[1-(2-Aminoéthyl)-1H-1,2,3-triazol-4-yl]{2-[5-(4-fluorophényl)-1,2,4-oxadiazol-3-yl]-1-azépanyl}méthanone [French] [ACD/IUPAC Name]
[1-(2-Aminoethyl)-1H-1,2,3-triazol-4-yl]{2-[5-(4-fluorphenyl)-1,2,4-oxadiazol-3-yl]-1-azepanyl}methanon [German] [ACD/IUPAC Name]
Methanone, [1-(2-aminoethyl)-1H-1,2,3-triazol-4-yl][2-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]hexahydro-1H-azepin-1-yl]- [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: 628.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.0±3.0 kJ/mol
Flash Point: 334.1±34.3 °C
Index of Refraction: 1.704
Molar Refractivity: 104.1±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.36
ACD/LogD (pH 5.5): -2.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.40
Polar Surface Area: 116 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 60.7±7.0 dyne/cm
Molar Volume: 268.1±7.0 cm3

Click to predict properties on the Chemicalize site


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