ChemSpider 2D Image | 10-[1-(4-Ethyl-1-piperazinyl)ethyl]-9-fluoro-2-(1-isopropyl-3-methyl-1H-1,2,4-triazol-5-yl)-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine | C25H34FN7O

10-[1-(4-Ethyl-1-piperazinyl)ethyl]-9-fluoro-2-(1-isopropyl-3-methyl-1H-1,2,4-triazol-5-yl)-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine

  • Molecular FormulaC25H34FN7O
  • Average mass467.582 Da
  • Monoisotopic mass467.280884 Da
  • ChemSpider ID58890615

More details:

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

10-[1-(4-Ethyl-1-piperazinyl)ethyl]-9-fluor-2-(1-isopropyl-3-methyl-1H-1,2,4-triazol-5-yl)-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepin [German] [ACD/IUPAC Name]
10-[1-(4-Ethyl-1-piperazinyl)ethyl]-9-fluoro-2-(1-isopropyl-3-methyl-1H-1,2,4-triazol-5-yl)-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine [ACD/IUPAC Name]
10-[1-(4-Éthyl-1-pipérazinyl)éthyl]-9-fluoro-2-(1-isopropyl-3-méthyl-1H-1,2,4-triazol-5-yl)-5,6-dihydroimidazo[1,2-d][1,4]benzoxazépine [French] [ACD/IUPAC Name]
Imidazo[1,2-d][1,4]benzoxazepine, 10-[1-(4-ethyl-1-piperazinyl)ethyl]-9-fluoro-5,6-dihydro-2-[3-methyl-1-(1-methylethyl)-1H-1,2,4-triazol-5-yl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 648.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.6±3.0 kJ/mol
Flash Point: 346.0±34.3 °C
Index of Refraction: 1.657
Molar Refractivity: 130.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.54
ACD/LogD (pH 5.5): 0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.78
ACD/LogD (pH 7.4): 1.85
ACD/BCF (pH 7.4): 11.06
ACD/KOC (pH 7.4): 137.14
Polar Surface Area: 64 Å2
Polarizability: 51.7±0.5 10-24cm3
Surface Tension: 46.1±7.0 dyne/cm
Molar Volume: 354.4±7.0 cm3

Click to predict properties on the Chemicalize site


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