ChemSpider 2D Image | N-(3,4-Difluorophenyl)-6-(3,5-dimethyl-1-piperidinyl)-N'-[2-(1H-imidazol-4-yl)ethyl]-1,3,5-triazine-2,4-diamine | C21H26F2N8

N-(3,4-Difluorophenyl)-6-(3,5-dimethyl-1-piperidinyl)-N'-[2-(1H-imidazol-4-yl)ethyl]-1,3,5-triazine-2,4-diamine

  • Molecular FormulaC21H26F2N8
  • Average mass428.482 Da
  • Monoisotopic mass428.224854 Da
  • ChemSpider ID124722819

More details:

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

1,3,5-Triazine-2,4-diamine, N2-(3,4-difluorophenyl)-6-(3,5-dimethyl-1-piperidinyl)-N4-[2-(1H-imidazol-4-yl)ethyl]- [ACD/Index Name]
N-(3,4-Difluorophenyl)-6-(3,5-dimethyl-1-piperidinyl)-N'-[2-(1H-imidazol-4-yl)ethyl]-1,3,5-triazine-2,4-diamine [ACD/IUPAC Name]
N-(3,4-Difluorophényl)-6-(3,5-diméthyl-1-pipéridinyl)-N'-[2-(1H-imidazol-4-yl)éthyl]-1,3,5-triazine-2,4-diamine [French] [ACD/IUPAC Name]
N-(3,4-Difluorphenyl)-6-(3,5-dimethyl-1-piperidinyl)-N'-[2-(1H-imidazol-4-yl)ethyl]-1,3,5-triazin-2,4-diamin [German] [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: 660.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.2±3.0 kJ/mol
Flash Point: 353.2±34.3 °C
Index of Refraction: 1.631
Molar Refractivity: 115.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.56
ACD/LogD (pH 5.5): 1.32
ACD/BCF (pH 5.5): 1.89
ACD/KOC (pH 5.5): 14.26
ACD/LogD (pH 7.4): 2.96
ACD/BCF (pH 7.4): 83.64
ACD/KOC (pH 7.4): 632.33
Polar Surface Area: 95 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 63.8±3.0 dyne/cm
Molar Volume: 324.0±3.0 cm3

Click to predict properties on the Chemicalize site


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