ChemSpider 2D Image | 2-{2-Fluoro-4-[(2S)-2-piperidinyl]phenyl}-1H-benzimidazole-4-carboxamide | C19H19FN4O

2-{2-Fluoro-4-[(2S)-2-piperidinyl]phenyl}-1H-benzimidazole-4-carboxamide

  • Molecular FormulaC19H19FN4O
  • Average mass338.379 Da
  • Monoisotopic mass338.154297 Da
  • ChemSpider ID24667558
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

1H-Benzimidazole-4-carboxamide, 2-[2-fluoro-4-[(2S)-2-piperidinyl]phenyl]- [ACD/Index Name]
2-{2-Fluor-4-[(2S)-2-piperidinyl]phenyl}-1H-benzimidazol-4-carboxamid [German] [ACD/IUPAC Name]
2-{2-Fluoro-4-[(2S)-2-piperidinyl]phenyl}-1H-benzimidazole-4-carboxamide [ACD/IUPAC Name]
2-{2-Fluoro-4-[(2S)-2-pipéridinyl]phényl}-1H-benzimidazole-4-carboxamide [French] [ACD/IUPAC Name]
2-{2-fluoro-4-[(2S)-piperidin-2-yl]phenyl}-1H-benzimidazole-7-carboxamide
A92

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 611.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.8±3.0 kJ/mol
Flash Point: 323.4±34.3 °C
Index of Refraction: 1.647
Molar Refractivity: 94.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.52
ACD/LogD (pH 5.5): -1.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.42
Polar Surface Area: 84 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 58.0±3.0 dyne/cm
Molar Volume: 260.5±3.0 cm3

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