ChemSpider 2D Image | 1-(4-{9-[(2,2,2-Trifluoroethyl)carbamoyl]-9H-fluoren-9-yl}butyl)-4-({[4'-(trifluoromethyl)-2-biphenylyl]carbonyl}amino)piperidinium | C39H38F6N3O2

1-(4-{9-[(2,2,2-Trifluoroethyl)carbamoyl]-9H-fluoren-9-yl}butyl)-4-({[4'-(trifluoromethyl)-2-biphenylyl]carbonyl}amino)piperidinium

  • Molecular FormulaC39H38F6N3O2
  • Average mass694.728 Da
  • Monoisotopic mass694.286255 Da
  • ChemSpider ID28639063

  • Charge - Charge

More details:

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

1-(4-{9-[(2,2,2-Trifluorethyl)carbamoyl]-9H-fluoren-9-yl}butyl)-4-({[4'-(trifluormethyl)-2-biphenylyl]carbonyl}amino)piperidinium [German] [ACD/IUPAC Name]
1-(4-{9-[(2,2,2-Trifluoroethyl)carbamoyl]-9H-fluoren-9-yl}butyl)-4-({[4'-(trifluoromethyl)-2-biphenylyl]carbonyl}amino)piperidinium [ACD/IUPAC Name]
1-(4-{9-[(2,2,2-Trifluoroéthyl)carbamoyl]-9H-fluorén-9-yl}butyl)-4-({[4'-(trifluorométhyl)-2-biphénylyl]carbonyl}amino)pipéridinium [French] [ACD/IUPAC Name]
9H-Fluorene-9-carboxamide, N-(2,2,2-trifluoroethyl)-9-[4-[4-[[[4'-(trifluoromethyl)[1,1'-biphenyl]-2-yl]carbonyl]amino]-1-piperidinyl]butyl]-, conjugate monoacid [ACD/Index Name]
1-(4-{9-[(2,2,2-trifluoroethyl)carbamoyl]-9H-fluoren-9-yl}butyl)-4-({[4'-(trifluoromethyl)biphenyl-2-yl]carbonyl}amino)piperidinium
lomitapide cation
lomitapide(1+)
  • Miscellaneous

    • Chemical Class:

      An ammonium ion resulting from the protonation of the nitrogen of the tertiary amino group of lomitapide. ChEBI CHEBI:72302

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

Density:
Boiling Point: 778.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.2±3.0 kJ/mol
Flash Point: 424.4±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 7.78
ACD/LogD (pH 5.5): 4.49
ACD/BCF (pH 5.5): 296.67
ACD/KOC (pH 5.5): 297.86
ACD/LogD (pH 7.4): 5.86
ACD/BCF (pH 7.4): 7065.37
ACD/KOC (pH 7.4): 7093.64
Polar Surface Area: 63 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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