ChemSpider 2D Image | 2-Chloro-N-[3-oxo-1-phenyl-3-({[1-(4-thiomorpholinyl)cyclopentyl]methyl}amino)propyl]benzamide | C26H32ClN3O2S

2-Chloro-N-[3-oxo-1-phenyl-3-({[1-(4-thiomorpholinyl)cyclopentyl]methyl}amino)propyl]benzamide

  • Molecular FormulaC26H32ClN3O2S
  • Average mass486.069 Da
  • Monoisotopic mass485.190369 Da
  • ChemSpider ID33371808

More details:

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

2-Chlor-N-[3-oxo-1-phenyl-3-({[1-(4-thiomorpholinyl)cyclopentyl]methyl}amino)propyl]benzamid [German] [ACD/IUPAC Name]
2-Chloro-N-[3-oxo-1-phenyl-3-({[1-(4-thiomorpholinyl)cyclopentyl]methyl}amino)propyl]benzamide [ACD/IUPAC Name]
2-Chloro-N-[3-oxo-1-phényl-3-({[1-(4-thiomorpholinyl)cyclopentyl]méthyl}amino)propyl]benzamide [French] [ACD/IUPAC Name]
Benzenepropanamide, β-[(2-chlorobenzoyl)amino]-N-[[1-(4-thiomorpholinyl)cyclopentyl]methyl]- [ACD/Index 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: 715.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.6±3.0 kJ/mol
Flash Point: 386.8±32.9 °C
Index of Refraction: 1.610
Molar Refractivity: 136.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.06
ACD/LogD (pH 5.5): 1.54
ACD/BCF (pH 5.5): 2.44
ACD/KOC (pH 5.5): 14.54
ACD/LogD (pH 7.4): 3.25
ACD/BCF (pH 7.4): 123.39
ACD/KOC (pH 7.4): 734.36
Polar Surface Area: 87 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 52.5±3.0 dyne/cm
Molar Volume: 392.5±3.0 cm3

Click to predict properties on the Chemicalize site


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