ChemSpider 2D Image | 3-Amino-N-[3-(4-amino-1-piperidinyl)-6-methyl-2-pyridinyl]-6-[3-(trifluoromethyl)-2-pyridinyl]-2-pyrazinecarboxamide | C22H23F3N8O

3-Amino-N-[3-(4-amino-1-piperidinyl)-6-methyl-2-pyridinyl]-6-[3-(trifluoromethyl)-2-pyridinyl]-2-pyrazinecarboxamide

  • Molecular FormulaC22H23F3N8O
  • Average mass472.466 Da
  • Monoisotopic mass472.194702 Da
  • ChemSpider ID76731961

More details:

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

2-Pyrazinecarboxamide, 3-amino-N-[3-(4-amino-1-piperidinyl)-6-methyl-2-pyridinyl]-6-[3-(trifluoromethyl)-2-pyridinyl]- [ACD/Index Name]
3-Amino-N-[3-(4-amino-1-piperidinyl)-6-methyl-2-pyridinyl]-6-[3-(trifluormethyl)-2-pyridinyl]-2-pyrazincarboxamid [German] [ACD/IUPAC Name]
3-Amino-N-[3-(4-amino-1-piperidinyl)-6-methyl-2-pyridinyl]-6-[3-(trifluoromethyl)-2-pyridinyl]-2-pyrazinecarboxamide [ACD/IUPAC Name]
3-Amino-N-[3-(4-amino-1-pipéridinyl)-6-méthyl-2-pyridinyl]-6-[3-(trifluorométhyl)-2-pyridinyl]-2-pyrazinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 604.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.9±3.0 kJ/mol
Flash Point: 319.6±31.5 °C
Index of Refraction: 1.629
Molar Refractivity: 120.2±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 3.62
ACD/LogD (pH 5.5): -0.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.20
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.03
Polar Surface Area: 136 Å2
Polarizability: 47.6±0.5 10-24cm3
Surface Tension: 63.8±3.0 dyne/cm
Molar Volume: 338.4±3.0 cm3

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