ChemSpider 2D Image | N-(1-{[2-(2-Chlorophenyl)-2-(1-pyrrolidinyl)ethyl]amino}-3-methyl-1-oxo-2-butanyl)-3,5-dimethoxybenzamide | C26H34ClN3O4

N-(1-{[2-(2-Chlorophenyl)-2-(1-pyrrolidinyl)ethyl]amino}-3-methyl-1-oxo-2-butanyl)-3,5-dimethoxybenzamide

  • Molecular FormulaC26H34ClN3O4
  • Average mass488.019 Da
  • Monoisotopic mass487.223785 Da
  • ChemSpider ID21736064

More details:

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

Benzamide, N-[1-[[[2-(2-chlorophenyl)-2-(1-pyrrolidinyl)ethyl]amino]carbonyl]-2-methylpropyl]-3,5-dimethoxy- [ACD/Index Name]
N-(1-{[2-(2-Chlorophenyl)-2-(1-pyrrolidinyl)ethyl]amino}-3-methyl-1-oxo-2-butanyl)-3,5-dimethoxybenzamide [ACD/IUPAC Name]
N-(1-{[2-(2-Chlorophényl)-2-(1-pyrrolidinyl)éthyl]amino}-3-méthyl-1-oxo-2-butanyl)-3,5-diméthoxybenzamide [French] [ACD/IUPAC Name]
N-(1-{[2-(2-Chlorphenyl)-2-(1-pyrrolidinyl)ethyl]amino}-3-methyl-1-oxo-2-butanyl)-3,5-dimethoxybenzamid [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 656.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.6±3.0 kJ/mol
Flash Point: 350.8±31.5 °C
Index of Refraction: 1.568
Molar Refractivity: 134.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.13
ACD/LogD (pH 5.5): 1.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.14
ACD/LogD (pH 7.4): 2.71
ACD/BCF (pH 7.4): 47.47
ACD/KOC (pH 7.4): 362.91
Polar Surface Area: 80 Å2
Polarizability: 53.1±0.5 10-24cm3
Surface Tension: 46.8±3.0 dyne/cm
Molar Volume: 409.3±3.0 cm3

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