ChemSpider 2D Image | 4-({1-[(2R)-4-Benzoyl-2-methyl-1-piperazinyl]-1-oxo-2-propanyl}oxy)-N-methylbenzamide | C23H27N3O4

4-({1-[(2R)-4-Benzoyl-2-methyl-1-piperazinyl]-1-oxo-2-propanyl}oxy)-N-methylbenzamide

  • Molecular FormulaC23H27N3O4
  • Average mass409.478 Da
  • Monoisotopic mass409.200165 Da
  • ChemSpider ID24635343
  • defined stereocentres - 1 of 2 defined stereocentres


More details:






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

4-({1-[(2R)-4-Benzoyl-2-methyl-1-piperazinyl]-1-oxo-2-propanyl}oxy)-N-methylbenzamid [German] [ACD/IUPAC Name]
4-({1-[(2R)-4-Benzoyl-2-methyl-1-piperazinyl]-1-oxo-2-propanyl}oxy)-N-methylbenzamide [ACD/IUPAC Name]
4-({1-[(2R)-4-Benzoyl-2-méthyl-1-pipérazinyl]-1-oxo-2-propanyl}oxy)-N-méthylbenzamide [French] [ACD/IUPAC Name]
Benzamide, 4-[2-[(2R)-4-benzoyl-2-methyl-1-piperazinyl]-1-methyl-2-oxoethoxy]-N-methyl- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 662.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.4±3.0 kJ/mol
Flash Point: 354.3±31.5 °C
Index of Refraction: 1.578
Molar Refractivity: 113.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.81
ACD/LogD (pH 5.5): 1.27
ACD/BCF (pH 5.5): 5.47
ACD/KOC (pH 5.5): 117.46
ACD/LogD (pH 7.4): 1.27
ACD/BCF (pH 7.4): 5.47
ACD/KOC (pH 7.4): 117.46
Polar Surface Area: 79 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 47.6±3.0 dyne/cm
Molar Volume: 342.5±3.0 cm3

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