ChemSpider 2D Image | 3-Bromo-N-{1-[6-(trifluoromethyl)-4-pyrimidinyl]-4-piperidinyl}benzamide | C17H16BrF3N4O

3-Bromo-N-{1-[6-(trifluoromethyl)-4-pyrimidinyl]-4-piperidinyl}benzamide

  • Molecular FormulaC17H16BrF3N4O
  • Average mass429.234 Da
  • Monoisotopic mass428.045959 Da
  • ChemSpider ID34486246

More details:

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

3-Brom-N-{1-[6-(trifluormethyl)-4-pyrimidinyl]-4-piperidinyl}benzamid [German] [ACD/IUPAC Name]
3-Bromo-N-{1-[6-(trifluoromethyl)-4-pyrimidinyl]-4-piperidinyl}benzamide [ACD/IUPAC Name]
3-Bromo-N-{1-[6-(trifluorométhyl)-4-pyrimidinyl]-4-pipéridinyl}benzamide [French] [ACD/IUPAC Name]
Benzamide, 3-bromo-N-[1-[6-(trifluoromethyl)-4-pyrimidinyl]-4-piperidinyl]- [ACD/Index Name]
2034258-74-5 [RN]
3-bromo-N-(1-(6-(trifluoromethyl)pyrimidin-4-yl)piperidin-4-yl)benzamide
3-bromo-N-{1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}benzamide

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

Density: 1.6±0.1 g/cm3
Boiling Point: 552.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 287.9±30.1 °C
Index of Refraction: 1.603
Molar Refractivity: 93.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.89
ACD/LogD (pH 5.5): 3.68
ACD/BCF (pH 5.5): 367.82
ACD/KOC (pH 5.5): 2386.64
ACD/LogD (pH 7.4): 3.68
ACD/BCF (pH 7.4): 368.71
ACD/KOC (pH 7.4): 2392.38
Polar Surface Area: 58 Å2
Polarizability: 36.9±0.5 10-24cm3
Surface Tension: 58.6±5.0 dyne/cm
Molar Volume: 271.2±5.0 cm3

Click to predict properties on the Chemicalize site


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