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Search term: VKSOPSKGVOYVSG (Found by InChIKey (skeleton match))

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

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

  • Molecular FormulaC19H28N8
  • Average mass368.479 Da
  • Monoisotopic mass368.243683 Da
  • ChemSpider ID30925697

More details:






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

4-{4-Ethyl-5-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl}-1-[(4-methyl-1H-imidazol-5-yl)methyl]piperidin [German] [ACD/IUPAC Name]
4-{4-Ethyl-5-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl}-1-[(4-methyl-1H-imidazol-5-yl)methyl]piperidine [ACD/IUPAC Name]
4-{4-Éthyl-5-[(2-méthyl-1H-imidazol-1-yl)méthyl]-4H-1,2,4-triazol-3-yl}-1-[(4-méthyl-1H-imidazol-5-yl)méthyl]pipéridine [French] [ACD/IUPAC Name]
Piperidine, 4-[4-ethyl-5-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl]-1-[(5-methyl-1H-imidazol-4-yl)methyl]- [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: 673.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.0±3.0 kJ/mol
Flash Point: 361.3±34.3 °C
Index of Refraction: 1.693
Molar Refractivity: 106.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.07
ACD/LogD (pH 5.5): -2.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.26
Polar Surface Area: 80 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 52.5±7.0 dyne/cm
Molar Volume: 277.6±7.0 cm3

Click to predict properties on the Chemicalize site






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