ChemSpider 2D Image | 6-[4-(1,5-Dimethyl-1H-1,2,4-triazol-3-yl)-1-piperidinyl]-N-ethyl-2-(2-methyl-2-propanyl)-N-[2-(4-pyridinyl)ethyl]-4-pyrimidinamine | C26H38N8

6-[4-(1,5-Dimethyl-1H-1,2,4-triazol-3-yl)-1-piperidinyl]-N-ethyl-2-(2-methyl-2-propanyl)-N-[2-(4-pyridinyl)ethyl]-4-pyrimidinamine

  • Molecular FormulaC26H38N8
  • Average mass462.634 Da
  • Monoisotopic mass462.321930 Da
  • ChemSpider ID121851968

More details:

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

4-Pyrimidinamine, 2-(1,1-dimethylethyl)-6-[4-(1,5-dimethyl-1H-1,2,4-triazol-3-yl)-1-piperidinyl]-N-ethyl-N-[2-(4-pyridinyl)ethyl]- [ACD/Index Name]
6-[4-(1,5-Dimethyl-1H-1,2,4-triazol-3-yl)-1-piperidinyl]-N-ethyl-2-(2-methyl-2-propanyl)-N-[2-(4-pyridinyl)ethyl]-4-pyrimidinamin [German] [ACD/IUPAC Name]
6-[4-(1,5-Dimethyl-1H-1,2,4-triazol-3-yl)-1-piperidinyl]-N-ethyl-2-(2-methyl-2-propanyl)-N-[2-(4-pyridinyl)ethyl]-4-pyrimidinamine [ACD/IUPAC Name]
6-[4-(1,5-Diméthyl-1H-1,2,4-triazol-3-yl)-1-pipéridinyl]-N-éthyl-2-(2-méthyl-2-propanyl)-N-[2-(4-pyridinyl)éthyl]-4-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: 671.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 98.7±3.0 kJ/mol
Flash Point: 360.0±34.3 °C
Index of Refraction: 1.624
Molar Refractivity: 138.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.78
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 3.67
ACD/KOC (pH 5.5): 15.26
ACD/LogD (pH 7.4): 3.91
ACD/BCF (pH 7.4): 381.82
ACD/KOC (pH 7.4): 1586.50
Polar Surface Area: 76 Å2
Polarizability: 55.0±0.5 10-24cm3
Surface Tension: 43.7±7.0 dyne/cm
Molar Volume: 392.7±7.0 cm3

Click to predict properties on the Chemicalize site


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