ChemSpider 2D Image | 4-{2-[(2-Fluorobenzoyl)amino]-3-oxo-3-[3-(4-phenylbutanoyl)-1-piperidinyl]propyl}phenyl acetate | C33H35FN2O5

4-{2-[(2-Fluorobenzoyl)amino]-3-oxo-3-[3-(4-phenylbutanoyl)-1-piperidinyl]propyl}phenyl acetate

  • Molecular FormulaC33H35FN2O5
  • Average mass558.640 Da
  • Monoisotopic mass558.252991 Da
  • ChemSpider ID122267055

More details:

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

4-{2-[(2-Fluorbenzoyl)amino]-3-oxo-3-[3-(4-phenylbutanoyl)-1-piperidinyl]propyl}phenyl-acetat [German] [ACD/IUPAC Name]
4-{2-[(2-Fluorobenzoyl)amino]-3-oxo-3-[3-(4-phenylbutanoyl)-1-piperidinyl]propyl}phenyl acetate [ACD/IUPAC Name]
Acétate de 4-{2-[(2-fluorobenzoyl)amino]-3-oxo-3-[3-(4-phénylbutanoyl)-1-pipéridinyl]propyl}phényle [French] [ACD/IUPAC Name]
Benzamide, N-[1-[[4-(acetyloxy)phenyl]methyl]-2-oxo-2-[3-(1-oxo-4-phenylbutyl)-1-piperidinyl]ethyl]-2-fluoro- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 764.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.3±3.0 kJ/mol
Flash Point: 415.9±32.9 °C
Index of Refraction: 1.580
Molar Refractivity: 152.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 4.35
ACD/LogD (pH 5.5): 4.96
ACD/BCF (pH 5.5): 3485.87
ACD/KOC (pH 5.5): 11944.84
ACD/LogD (pH 7.4): 4.96
ACD/BCF (pH 7.4): 3485.84
ACD/KOC (pH 7.4): 11944.76
Polar Surface Area: 93 Å2
Polarizability: 60.4±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 457.9±3.0 cm3

Click to predict properties on the Chemicalize site


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