ChemSpider 2D Image | 1-Acetyl-N-(3-chlorophenyl)-N-(3-{4-[(2-phenylethyl)carbamoyl]-1-piperidinyl}propyl)-4-piperidinecarboxamide | C31H41ClN4O3

1-Acetyl-N-(3-chlorophenyl)-N-(3-{4-[(2-phenylethyl)carbamoyl]-1-piperidinyl}propyl)-4-piperidinecarboxamide

  • Molecular FormulaC31H41ClN4O3
  • Average mass553.135 Da
  • Monoisotopic mass552.286743 Da
  • ChemSpider ID31127500

More details:

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

1-Acetyl-N-(3-chlorophenyl)-N-(3-{4-[(2-phenylethyl)carbamoyl]-1-piperidinyl}propyl)-4-piperidinecarboxamide [ACD/IUPAC Name]
1-Acétyl-N-(3-chlorophényl)-N-(3-{4-[(2-phényléthyl)carbamoyl]-1-pipéridinyl}propyl)-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
1-Acetyl-N-(3-chlorphenyl)-N-(3-{4-[(2-phenylethyl)carbamoyl]-1-piperidinyl}propyl)-4-piperidincarboxamid [German] [ACD/IUPAC Name]
4-Piperidinecarboxamide, 1-acetyl-N-(3-chlorophenyl)-N-[3-[4-[[(2-phenylethyl)amino]carbonyl]-1-piperidinyl]propyl]- [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: 764.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.3±3.0 kJ/mol
Flash Point: 416.2±32.9 °C
Index of Refraction: 1.586
Molar Refractivity: 155.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 3.63
ACD/LogD (pH 5.5): 1.79
ACD/BCF (pH 5.5): 3.37
ACD/KOC (pH 5.5): 16.18
ACD/LogD (pH 7.4): 3.49
ACD/BCF (pH 7.4): 170.04
ACD/KOC (pH 7.4): 815.81
Polar Surface Area: 73 Å2
Polarizability: 61.4±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 461.7±3.0 cm3

Click to predict properties on the Chemicalize site


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