ChemSpider 2D Image | 2-(1H-Imidazol-1-yl)-N-{[3-(1-naphthyl)-1H-pyrazol-4-yl]methyl}-1-phenylethanamine | C25H23N5

2-(1H-Imidazol-1-yl)-N-{[3-(1-naphthyl)-1H-pyrazol-4-yl]methyl}-1-phenylethanamine

  • Molecular FormulaC25H23N5
  • Average mass393.484 Da
  • Monoisotopic mass393.195343 Da
  • ChemSpider ID22502331

More details:

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

1H-Pyrazole-4-methanamine, N-[2-(1H-imidazol-1-yl)-1-phenylethyl]-3-(1-naphthalenyl)- [ACD/Index Name]
2-(1H-Imidazol-1-yl)-N-{[3-(1-naphthyl)-1H-pyrazol-4-yl]methyl}-1-phenylethanamin [German] [ACD/IUPAC Name]
2-(1H-Imidazol-1-yl)-N-{[3-(1-naphthyl)-1H-pyrazol-4-yl]methyl}-1-phenylethanamine [ACD/IUPAC Name]
2-(1H-Imidazol-1-yl)-N-{[3-(1-naphtyl)-1H-pyrazol-4-yl]méthyl}-1-phényléthanamine [French] [ACD/IUPAC Name]
[2-(1H-IMIDAZOL-1-YL)-1-PHENYLETHYL]({[3-(NAPHTHALEN-1-YL)-1H-PYRAZOL-4-YL]METHYL})AMINE
[2-(IMIDAZOL-1-YL)-1-PHENYLETHYL]({[3-(NAPHTHALEN-1-YL)-1H-PYRAZOL-4-YL]METHYL})AMINE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 686.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.6±3.0 kJ/mol
Flash Point: 368.9±31.5 °C
Index of Refraction: 1.677
Molar Refractivity: 121.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.44
ACD/LogD (pH 5.5): 2.22
ACD/BCF (pH 5.5): 8.84
ACD/KOC (pH 5.5): 40.68
ACD/LogD (pH 7.4): 4.25
ACD/BCF (pH 7.4): 932.07
ACD/KOC (pH 7.4): 4290.66
Polar Surface Area: 59 Å2
Polarizability: 48.0±0.5 10-24cm3
Surface Tension: 50.7±7.0 dyne/cm
Molar Volume: 321.8±7.0 cm3

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