ChemSpider 2D Image | N-[2-({4-(Dimethylamino)-2-[(4-methoxybenzyl)amino]cyclohexyl}amino)-2-oxoethyl]-3-(trifluoromethyl)benzamide | C26H33F3N4O3

N-[2-({4-(Dimethylamino)-2-[(4-methoxybenzyl)amino]cyclohexyl}amino)-2-oxoethyl]-3-(trifluoromethyl)benzamide

  • Molecular FormulaC26H33F3N4O3
  • Average mass506.560 Da
  • Monoisotopic mass506.250488 Da
  • ChemSpider ID24699330

More details:

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

Benzamide, N-[2-[[4-(dimethylamino)-2-[[(4-methoxyphenyl)methyl]amino]cyclohexyl]amino]-2-oxoethyl]-3-(trifluoromethyl)- [ACD/Index Name]
N-[2-({4-(Dimethylamino)-2-[(4-methoxybenzyl)amino]cyclohexyl}amino)-2-oxoethyl]-3-(trifluormethyl)benzamid [German] [ACD/IUPAC Name]
N-[2-({4-(Dimethylamino)-2-[(4-methoxybenzyl)amino]cyclohexyl}amino)-2-oxoethyl]-3-(trifluoromethyl)benzamide [ACD/IUPAC Name]
N-[2-({4-(Diméthylamino)-2-[(4-méthoxybenzyl)amino]cyclohexyl}amino)-2-oxoéthyl]-3-(trifluorométhyl)benzamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 668.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.2±3.0 kJ/mol
Flash Point: 357.9±31.5 °C
Index of Refraction: 1.564
Molar Refractivity: 131.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 3.17
ACD/LogD (pH 5.5): -0.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.30
Polar Surface Area: 83 Å2
Polarizability: 52.1±0.5 10-24cm3
Surface Tension: 48.2±5.0 dyne/cm
Molar Volume: 404.1±5.0 cm3

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