ChemSpider 2D Image | N,1-Bis(4-chlorobenzyl)-5-(2-hydroxy-5-methylbenzoyl)-2-oxo-1,2-dihydro-3-pyridinecarboxamide | C28H22Cl2N2O4

N,1-Bis(4-chlorobenzyl)-5-(2-hydroxy-5-methylbenzoyl)-2-oxo-1,2-dihydro-3-pyridinecarboxamide

  • Molecular FormulaC28H22Cl2N2O4
  • Average mass521.391 Da
  • Monoisotopic mass520.095642 Da
  • ChemSpider ID1768935

More details:

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

3-Pyridinecarboxamide, N,1-bis[(4-chlorophenyl)methyl]-1,2-dihydro-5-(2-hydroxy-5-methylbenzoyl)-2-oxo- [ACD/Index Name]
N,1-Bis(4-chlorbenzyl)-5-(2-hydroxy-5-methylbenzoyl)-2-oxo-1,2-dihydro-3-pyridincarboxamid [German] [ACD/IUPAC Name]
N,1-Bis(4-chlorobenzyl)-5-(2-hydroxy-5-methylbenzoyl)-2-oxo-1,2-dihydro-3-pyridinecarboxamide [ACD/IUPAC Name]
N,1-Bis(4-chlorobenzyl)-5-(2-hydroxy-5-méthylbenzoyl)-2-oxo-1,2-dihydro-3-pyridinecarboxamide [French] [ACD/IUPAC Name]

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

ZINC03250985 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 745.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.6±3.0 kJ/mol
Flash Point: 404.8±32.9 °C
Index of Refraction: 1.669
Molar Refractivity: 138.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.44
ACD/LogD (pH 5.5): 4.68
ACD/BCF (pH 5.5): 2141.38
ACD/KOC (pH 5.5): 8421.54
ACD/LogD (pH 7.4): 4.61
ACD/BCF (pH 7.4): 1783.60
ACD/KOC (pH 7.4): 7014.46
Polar Surface Area: 87 Å2
Polarizability: 54.9±0.5 10-24cm3
Surface Tension: 63.5±3.0 dyne/cm
Molar Volume: 371.3±3.0 cm3

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