ChemSpider 2D Image | N-[1-(4-Isobutylbenzyl)-3-piperidinyl]-4-(4-methyl-1-piperazinyl)benzamide | C28H40N4O

N-[1-(4-Isobutylbenzyl)-3-piperidinyl]-4-(4-methyl-1-piperazinyl)benzamide

  • Molecular FormulaC28H40N4O
  • Average mass448.643 Da
  • Monoisotopic mass448.320221 Da
  • ChemSpider ID22221611

More details:

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

Benzamide, 4-(4-methyl-1-piperazinyl)-N-[1-[[4-(2-methylpropyl)phenyl]methyl]-3-piperidinyl]- [ACD/Index Name]
N-[1-(4-Isobutylbenzyl)-3-piperidinyl]-4-(4-methyl-1-piperazinyl)benzamid [German] [ACD/IUPAC Name]
N-[1-(4-Isobutylbenzyl)-3-piperidinyl]-4-(4-methyl-1-piperazinyl)benzamide [ACD/IUPAC Name]
N-[1-(4-Isobutylbenzyl)-3-pipéridinyl]-4-(4-méthyl-1-pipérazinyl)benzamide [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 610.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.7±3.0 kJ/mol
Flash Point: 323.2±31.5 °C
Index of Refraction: 1.606
Molar Refractivity: 136.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.44
ACD/LogD (pH 5.5): 0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 2.65
ACD/BCF (pH 7.4): 24.65
ACD/KOC (pH 7.4): 117.68
Polar Surface Area: 39 Å2
Polarizability: 54.2±0.5 10-24cm3
Surface Tension: 51.8±5.0 dyne/cm
Molar Volume: 396.7±5.0 cm3

Click to predict properties on the Chemicalize site


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