ChemSpider 2D Image | N-[2-(3-[3,5-Bis(trifluoromethyl)phenyl]-4-{[3-(1H-imidazol-1-yl)propyl]amino}-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)ethyl]acetamide | C22H21F6N5O3

N-[2-(3-[3,5-Bis(trifluoromethyl)phenyl]-4-{[3-(1H-imidazol-1-yl)propyl]amino}-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)ethyl]acetamide

  • Molecular FormulaC22H21F6N5O3
  • Average mass517.424 Da
  • Monoisotopic mass517.154846 Da
  • ChemSpider ID125414121

More details:

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

Acetamide, N-[2-[3-[3,5-bis(trifluoromethyl)phenyl]-2,5-dihydro-4-[[3-(1H-imidazol-1-yl)propyl]amino]-2,5-dioxo-1H-pyrrol-1-yl]ethyl]- [ACD/Index Name]
N-[2-(3-[3,5-Bis(trifluormethyl)phenyl]-4-{[3-(1H-imidazol-1-yl)propyl]amino}-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)ethyl]acetamid [German] [ACD/IUPAC Name]
N-[2-(3-[3,5-Bis(trifluoromethyl)phenyl]-4-{[3-(1H-imidazol-1-yl)propyl]amino}-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)ethyl]acetamide [ACD/IUPAC Name]
N-[2-(3-[3,5-Bis(trifluorométhyl)phényl]-4-{[3-(1H-imidazol-1-yl)propyl]amino}-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)éthyl]acétamide [French] [ACD/IUPAC 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: 669.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.4±3.0 kJ/mol
Flash Point: 358.9±31.5 °C
Index of Refraction: 1.566
Molar Refractivity: 116.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 0.18
ACD/LogD (pH 5.5): 0.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.83
ACD/LogD (pH 7.4): 1.27
ACD/BCF (pH 7.4): 5.11
ACD/KOC (pH 7.4): 103.86
Polar Surface Area: 96 Å2
Polarizability: 46.0±0.5 10-24cm3
Surface Tension: 42.4±7.0 dyne/cm
Molar Volume: 355.5±7.0 cm3

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