ChemSpider 2D Image | 4-[(5-Bromo-1-benzofuran-2-yl)carbonyl]-3-hydroxy-1-[4-(1-piperidinyl)phenyl]-5-(3-pyridinyl)-1,5-dihydro-2H-pyrrol-2-one | C29H24BrN3O4

4-[(5-Bromo-1-benzofuran-2-yl)carbonyl]-3-hydroxy-1-[4-(1-piperidinyl)phenyl]-5-(3-pyridinyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC29H24BrN3O4
  • Average mass558.423 Da
  • Monoisotopic mass557.095032 Da
  • ChemSpider ID34929308

More details:

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

2H-Pyrrol-2-one, 4-[(5-bromo-2-benzofuranyl)carbonyl]-1,5-dihydro-3-hydroxy-1-[4-(1-piperidinyl)phenyl]-5-(3-pyridinyl)- [ACD/Index Name]
4-[(5-Brom-1-benzofuran-2-yl)carbonyl]-3-hydroxy-1-[4-(1-piperidinyl)phenyl]-5-(3-pyridinyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
4-[(5-Bromo-1-benzofuran-2-yl)carbonyl]-3-hydroxy-1-[4-(1-piperidinyl)phenyl]-5-(3-pyridinyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
4-[(5-Bromo-1-benzofuran-2-yl)carbonyl]-3-hydroxy-1-[4-(1-pipéridinyl)phényl]-5-(3-pyridinyl)-1,5-dihydro-2H-pyrrol-2-one [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: 718.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 110.1±3.0 kJ/mol
Flash Point: 388.0±32.9 °C
Index of Refraction: 1.706
Molar Refractivity: 142.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 4.44
ACD/LogD (pH 5.5): 2.64
ACD/BCF (pH 5.5): 34.67
ACD/KOC (pH 5.5): 230.93
ACD/LogD (pH 7.4): 1.12
ACD/BCF (pH 7.4): 1.04
ACD/KOC (pH 7.4): 6.96
Polar Surface Area: 87 Å2
Polarizability: 56.5±0.5 10-24cm3
Surface Tension: 68.9±3.0 dyne/cm
Molar Volume: 366.5±3.0 cm3

Click to predict properties on the Chemicalize site


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