ChemSpider 2D Image | 1-(1-Azepanyl)-2-[2-(1-azepanylmethyl)-1H-benzimidazol-1-yl]ethanone | C22H32N4O

1-(1-Azepanyl)-2-[2-(1-azepanylmethyl)-1H-benzimidazol-1-yl]ethanone

  • Molecular FormulaC22H32N4O
  • Average mass368.516 Da
  • Monoisotopic mass368.257599 Da
  • ChemSpider ID23380392

More details:

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

1-(1-Azepanyl)-2-[2-(1-azepanylmethyl)-1H-benzimidazol-1-yl]ethanon [German] [ACD/IUPAC Name]
1-(1-Azepanyl)-2-[2-(1-azepanylmethyl)-1H-benzimidazol-1-yl]ethanone [ACD/IUPAC Name]
1-(1-Azépanyl)-2-[2-(1-azépanylméthyl)-1H-benzimidazol-1-yl]éthanone [French] [ACD/IUPAC Name]
1-(Azepan-1-yl)-2-[2-(azepan-1-ylmethyl)-1H-benzimidazol-1-yl]ethanone
Ethanone, 1-(hexahydro-1H-azepin-1-yl)-2-[2-[(hexahydro-1H-azepin-1-yl)methyl]-1H-benzimidazol-1-yl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 571.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.7±3.0 kJ/mol
Flash Point: 299.3±25.9 °C
Index of Refraction: 1.632
Molar Refractivity: 109.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.19
ACD/LogD (pH 5.5): 1.53
ACD/BCF (pH 5.5): 2.40
ACD/KOC (pH 5.5): 14.45
ACD/LogD (pH 7.4): 3.24
ACD/BCF (pH 7.4): 121.84
ACD/KOC (pH 7.4): 731.95
Polar Surface Area: 41 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 49.1±7.0 dyne/cm
Molar Volume: 306.9±7.0 cm3

Click to predict properties on the Chemicalize site


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