ChemSpider 2D Image | 1-[(1-Ethyl-1H-pyrazol-4-yl)methyl]-3-{4-methyl-5-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl}piperidine | C19H28N8

1-[(1-Ethyl-1H-pyrazol-4-yl)methyl]-3-{4-methyl-5-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl}piperidine

  • Molecular FormulaC19H28N8
  • Average mass368.479 Da
  • Monoisotopic mass368.243683 Da
  • ChemSpider ID29489385

More details:

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

1-[(1-Ethyl-1H-pyrazol-4-yl)methyl]-3-{4-methyl-5-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl}piperidin [German] [ACD/IUPAC Name]
1-[(1-Ethyl-1H-pyrazol-4-yl)methyl]-3-{4-methyl-5-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl}piperidine [ACD/IUPAC Name]
1-[(1-Éthyl-1H-pyrazol-4-yl)méthyl]-3-{4-méthyl-5-[(2-méthyl-1H-imidazol-1-yl)méthyl]-4H-1,2,4-triazol-3-yl}pipéridine [French] [ACD/IUPAC Name]
Piperidine, 1-[(1-ethyl-1H-pyrazol-4-yl)methyl]-3-[4-methyl-5-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl]- [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: 605.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.1±3.0 kJ/mol
Flash Point: 320.2±34.3 °C
Index of Refraction: 1.682
Molar Refractivity: 107.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.04
ACD/LogD (pH 5.5): -2.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 25.87
Polar Surface Area: 70 Å2
Polarizability: 42.6±0.5 10-24cm3
Surface Tension: 52.0±7.0 dyne/cm
Molar Volume: 283.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement