ChemSpider 2D Image | 2-(2-{[2-(1H-Benzimidazol-2-yl)ethyl]amino}ethyl)-N-[(3-fluoro-2-pyridinyl)methyl]-1,3-oxazole-4-carboxamide | C21H21FN6O2

2-(2-{[2-(1H-Benzimidazol-2-yl)ethyl]amino}ethyl)-N-[(3-fluoro-2-pyridinyl)methyl]-1,3-oxazole-4-carboxamide

  • Molecular FormulaC21H21FN6O2
  • Average mass408.429 Da
  • Monoisotopic mass408.170990 Da
  • ChemSpider ID103746305

More details:

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

2-(2-{[2-(1H-Benzimidazol-2-yl)ethyl]amino}ethyl)-N-[(3-fluor-2-pyridinyl)methyl]-1,3-oxazol-4-carboxamid [German] [ACD/IUPAC Name]
2-(2-{[2-(1H-Benzimidazol-2-yl)ethyl]amino}ethyl)-N-[(3-fluoro-2-pyridinyl)methyl]-1,3-oxazole-4-carboxamide [ACD/IUPAC Name]
2-(2-{[2-(1H-Benzimidazol-2-yl)éthyl]amino}éthyl)-N-[(3-fluoro-2-pyridinyl)méthyl]-1,3-oxazole-4-carboxamide [French] [ACD/IUPAC Name]
4-Oxazolecarboxamide, 2-[2-[[2-(1H-benzimidazol-2-yl)ethyl]amino]ethyl]-N-[(3-fluoro-2-pyridinyl)methyl]- [ACD/Index Name]
2095668-10-1 [RN]
Vamifeport
VIT-2763

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

Density: 1.3±0.1 g/cm3
Boiling Point: 727.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.3±3.0 kJ/mol
Flash Point: 394.0±32.9 °C
Index of Refraction: 1.642
Molar Refractivity: 110.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 0.33
ACD/LogD (pH 5.5): -1.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.83
Polar Surface Area: 109 Å2
Polarizability: 43.6±0.5 10-24cm3
Surface Tension: 62.0±3.0 dyne/cm
Molar Volume: 304.9±3.0 cm3

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