ChemSpider 2D Image | N-(4-{[4-(4-Ethyl-1-piperazinyl)-2-methylphenyl]amino}-4-oxobutyl)-1-adamantanecarboxamide | C28H42N4O2

N-(4-{[4-(4-Ethyl-1-piperazinyl)-2-methylphenyl]amino}-4-oxobutyl)-1-adamantanecarboxamide

  • Molecular FormulaC28H42N4O2
  • Average mass466.659 Da
  • Monoisotopic mass466.330780 Da
  • ChemSpider ID22535268

More details:

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

N-(4-{[4-(4-Ethyl-1-piperazinyl)-2-methylphenyl]amino}-4-oxobutyl)-1-adamantancarboxamid [German] [ACD/IUPAC Name]
N-(4-{[4-(4-Ethyl-1-piperazinyl)-2-methylphenyl]amino}-4-oxobutyl)-1-adamantanecarboxamide [ACD/IUPAC Name]
N-(4-{[4-(4-Éthyl-1-pipérazinyl)-2-méthylphényl]amino}-4-oxobutyl)-1-adamantanecarboxamide [French] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-1-carboxamide, N-[4-[[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]amino]-4-oxobutyl]- [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: 707.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 103.5±3.0 kJ/mol
Flash Point: 381.7±32.9 °C
Index of Refraction: 1.592
Molar Refractivity: 136.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.75
ACD/LogD (pH 5.5): 1.55
ACD/BCF (pH 5.5): 2.52
ACD/KOC (pH 5.5): 15.24
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 107.13
ACD/KOC (pH 7.4): 648.88
Polar Surface Area: 65 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 50.9±3.0 dyne/cm
Molar Volume: 401.9±3.0 cm3

Click to predict properties on the Chemicalize site


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