ChemSpider 2D Image | 3-Methyl-5-(4-{2-[2-(1H-pyrazol-1-ylmethyl)phenyl]-1H-imidazol-1-yl}phenyl)-1H-1,2,4-triazole | C22H19N7

3-Methyl-5-(4-{2-[2-(1H-pyrazol-1-ylmethyl)phenyl]-1H-imidazol-1-yl}phenyl)-1H-1,2,4-triazole

  • Molecular FormulaC22H19N7
  • Average mass381.433 Da
  • Monoisotopic mass381.170197 Da
  • ChemSpider ID29621695

More details:

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

3-Methyl-5-(4-{2-[2-(1H-pyrazol-1-ylmethyl)phenyl]-1H-imidazol-1-yl}phenyl)-1H-1,2,4-triazol [German] [ACD/IUPAC Name]
3-Methyl-5-(4-{2-[2-(1H-pyrazol-1-ylmethyl)phenyl]-1H-imidazol-1-yl}phenyl)-1H-1,2,4-triazole [ACD/IUPAC Name]
3-Méthyl-5-(4-{2-[2-(1H-pyrazol-1-ylméthyl)phényl]-1H-imidazol-1-yl}phényl)-1H-1,2,4-triazole [French] [ACD/IUPAC Name]
4H-1,2,4-Triazole, 3-methyl-5-[4-[2-[2-(1H-pyrazol-1-ylmethyl)phenyl]-1H-imidazol-1-yl]phenyl]- [ACD/Index 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: 699.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.4±3.0 kJ/mol
Flash Point: 377.0±34.3 °C
Index of Refraction: 1.723
Molar Refractivity: 114.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.38
ACD/LogD (pH 5.5): 2.59
ACD/BCF (pH 5.5): 54.63
ACD/KOC (pH 5.5): 604.98
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 55.99
ACD/KOC (pH 7.4): 620.07
Polar Surface Area: 77 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 56.2±7.0 dyne/cm
Molar Volume: 288.2±7.0 cm3

Click to predict properties on the Chemicalize site


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