ChemSpider 2D Image | 2-(1H-Imidazol-4-yl)-N-{[2-(propylsulfanyl)-5-pyrimidinyl]methyl}ethanamine | C13H19N5S

2-(1H-Imidazol-4-yl)-N-{[2-(propylsulfanyl)-5-pyrimidinyl]methyl}ethanamine

  • Molecular FormulaC13H19N5S
  • Average mass277.388 Da
  • Monoisotopic mass277.136108 Da
  • ChemSpider ID29581730

More details:

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

2-(1H-Imidazol-4-yl)-N-{[2-(propylsulfanyl)-5-pyrimidinyl]methyl}ethanamin [German] [ACD/IUPAC Name]
2-(1H-Imidazol-4-yl)-N-{[2-(propylsulfanyl)-5-pyrimidinyl]methyl}ethanamine [ACD/IUPAC Name]
2-(1H-Imidazol-4-yl)-N-{[2-(propylsulfanyl)-5-pyrimidinyl]méthyl}éthanamine [French] [ACD/IUPAC Name]
5-Pyrimidinemethanamine, N-[2-(1H-imidazol-4-yl)ethyl]-2-(propylthio)- [ACD/Index Name]
[2-(1H-IMIDAZOL-4-YL)ETHYL]({[2-(PROPYLSULFANYL)PYRIMIDIN-5-YL]METHYL})AMINE
2-(1H-imidazol-4-yl)-N-{[2-(propylthio)pyrimidin-5-yl]methyl}ethanamine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 520.4±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.3±3.0 kJ/mol
Flash Point: 268.5±25.9 °C
Index of Refraction: 1.602
Molar Refractivity: 78.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.05
ACD/LogD (pH 5.5): -1.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.67
ACD/BCF (pH 7.4): 1.27
ACD/KOC (pH 7.4): 25.77
Polar Surface Area: 92 Å2
Polarizability: 31.0±0.5 10-24cm3
Surface Tension: 63.7±5.0 dyne/cm
Molar Volume: 228.2±5.0 cm3

Click to predict properties on the Chemicalize site


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