ChemSpider 2D Image | 4-{4-[5-(Difluoromethyl)-1,2,4-oxadiazol-3-yl]-1-piperidinyl}-6-isopropyl-N,N-dimethyl-2-pyrimidinamine | C17H24F2N6O

4-{4-[5-(Difluoromethyl)-1,2,4-oxadiazol-3-yl]-1-piperidinyl}-6-isopropyl-N,N-dimethyl-2-pyrimidinamine

  • Molecular FormulaC17H24F2N6O
  • Average mass366.409 Da
  • Monoisotopic mass366.197968 Da
  • ChemSpider ID103755911

More details:

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

2-Pyrimidinamine, 4-[4-[5-(difluoromethyl)-1,2,4-oxadiazol-3-yl]-1-piperidinyl]-N,N-dimethyl-6-(1-methylethyl)- [ACD/Index Name]
4-{4-[5-(Difluormethyl)-1,2,4-oxadiazol-3-yl]-1-piperidinyl}-6-isopropyl-N,N-dimethyl-2-pyrimidinamin [German] [ACD/IUPAC Name]
4-{4-[5-(Difluoromethyl)-1,2,4-oxadiazol-3-yl]-1-piperidinyl}-6-isopropyl-N,N-dimethyl-2-pyrimidinamine [ACD/IUPAC Name]
4-{4-[5-(Difluorométhyl)-1,2,4-oxadiazol-3-yl]-1-pipéridinyl}-6-isopropyl-N,N-diméthyl-2-pyrimidinamine [French] [ACD/IUPAC 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: 508.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.9±3.0 kJ/mol
Flash Point: 261.2±32.9 °C
Index of Refraction: 1.544
Molar Refractivity: 93.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.50
ACD/LogD (pH 5.5): 0.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.61
ACD/LogD (pH 7.4): 0.98
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.33
Polar Surface Area: 71 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 48.6±3.0 dyne/cm
Molar Volume: 297.6±3.0 cm3

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