ChemSpider 2D Image | N,N-Bis{3-[(2,3-dihydroxybenzoyl)amino]propyl}-2-(2,3-dihydroxyphenyl)-5-methyl-4,5-dihydro-1,3-oxazole-4-carboxamide | C31H34N4O10

N,N-Bis{3-[(2,3-dihydroxybenzoyl)amino]propyl}-2-(2,3-dihydroxyphenyl)-5-methyl-4,5-dihydro-1,3-oxazole-4-carboxamide

  • Molecular FormulaC31H34N4O10
  • Average mass622.622 Da
  • Monoisotopic mass622.227478 Da
  • ChemSpider ID64884662

More details:

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

4-Oxazolecarboxamide, N,N-bis[3-[(2,3-dihydroxybenzoyl)amino]propyl]-2-(2,3-dihydroxyphenyl)-4,5-dihydro-5-methyl- [ACD/Index Name]
N,N-Bis{3-[(2,3-dihydroxybenzoyl)amino]propyl}-2-(2,3-dihydroxyphenyl)-5-methyl-4,5-dihydro-1,3-oxazol-4-carboxamid [German] [ACD/IUPAC Name]
N,N-Bis{3-[(2,3-dihydroxybenzoyl)amino]propyl}-2-(2,3-dihydroxyphenyl)-5-methyl-4,5-dihydro-1,3-oxazole-4-carboxamide [ACD/IUPAC Name]
N,N-Bis{3-[(2,3-dihydroxybenzoyl)amino]propyl}-2-(2,3-dihydroxyphényl)-5-méthyl-4,5-dihydro-1,3-oxazole-4-carboxamide [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: 925.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 139.3±3.0 kJ/mol
Flash Point: 513.7±34.3 °C
Index of Refraction: 1.667
Molar Refractivity: 157.2±0.5 cm3
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 2.67
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 24.72
ACD/KOC (pH 5.5): 345.14
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 20.90
ACD/KOC (pH 7.4): 291.85
Polar Surface Area: 221 Å2
Polarizability: 62.3±0.5 10-24cm3
Surface Tension: 62.5±7.0 dyne/cm
Molar Volume: 422.5±7.0 cm3

Click to predict properties on the Chemicalize site


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