ChemSpider 2D Image | N-(6-Butyl-5-methyl-7-oxo-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-(3-chlorobenzyl)-2-fluorobenzamide | C24H23ClFN5O2

N-(6-Butyl-5-methyl-7-oxo-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-(3-chlorobenzyl)-2-fluorobenzamide

  • Molecular FormulaC24H23ClFN5O2
  • Average mass467.923 Da
  • Monoisotopic mass467.152435 Da
  • ChemSpider ID29023850

More details:

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

Benzamide, N-(6-butyl-4,7-dihydro-5-methyl-7-oxo[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(3-chlorophenyl)methyl]-2-fluoro- [ACD/Index Name]
N-(6-Butyl-5-methyl-7-oxo-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-(3-chlorbenzyl)-2-fluorbenzamid [German] [ACD/IUPAC Name]
N-(6-Butyl-5-methyl-7-oxo-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-(3-chlorobenzyl)-2-fluorobenzamide [ACD/IUPAC Name]
N-(6-Butyl-5-méthyl-7-oxo-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-(3-chlorobenzyl)-2-fluorobenzamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 676.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.3±3.0 kJ/mol
Flash Point: 362.9±34.3 °C
Index of Refraction: 1.649
Molar Refractivity: 125.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.56
ACD/LogD (pH 5.5): 4.84
ACD/BCF (pH 5.5): 2821.72
ACD/KOC (pH 5.5): 10267.70
ACD/LogD (pH 7.4): 4.84
ACD/BCF (pH 7.4): 2821.73
ACD/KOC (pH 7.4): 10267.72
Polar Surface Area: 80 Å2
Polarizability: 49.9±0.5 10-24cm3
Surface Tension: 49.3±7.0 dyne/cm
Molar Volume: 345.3±7.0 cm3

Click to predict properties on the Chemicalize site


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