ChemSpider 2D Image | 3-{1-[(5-Acetyl-3-thienyl)methyl]-3-piperidinyl}-N-(3,4-difluorobenzyl)propanamide | C22H26F2N2O2S

3-{1-[(5-Acetyl-3-thienyl)methyl]-3-piperidinyl}-N-(3,4-difluorobenzyl)propanamide

  • Molecular FormulaC22H26F2N2O2S
  • Average mass420.516 Da
  • Monoisotopic mass420.168304 Da
  • ChemSpider ID22215011

More details:

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

3-{1-[(5-Acetyl-3-thienyl)methyl]-3-piperidinyl}-N-(3,4-difluorbenzyl)propanamid [German] [ACD/IUPAC Name]
3-{1-[(5-Acetyl-3-thienyl)methyl]-3-piperidinyl}-N-(3,4-difluorobenzyl)propanamide [ACD/IUPAC Name]
3-{1-[(5-Acétyl-3-thiényl)méthyl]-3-pipéridinyl}-N-(3,4-difluorobenzyl)propanamide [French] [ACD/IUPAC Name]
3-Piperidinepropanamide, 1-[(5-acetyl-3-thienyl)methyl]-N-[(3,4-difluorophenyl)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: 607.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.2±3.0 kJ/mol
Flash Point: 321.0±31.5 °C
Index of Refraction: 1.561
Molar Refractivity: 110.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.45
ACD/LogD (pH 5.5): 0.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.55
ACD/LogD (pH 7.4): 1.70
ACD/BCF (pH 7.4): 5.11
ACD/KOC (pH 7.4): 42.62
Polar Surface Area: 78 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 45.5±3.0 dyne/cm
Molar Volume: 342.5±3.0 cm3

Click to predict properties on the Chemicalize site


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