ChemSpider 2D Image | N-[2-({[6-(1-Azepanyl)-3-pyridinyl]methyl}amino)-2-oxoethyl]-2-iodobenzamide | C21H25IN4O2

N-[2-({[6-(1-Azepanyl)-3-pyridinyl]methyl}amino)-2-oxoethyl]-2-iodobenzamide

  • Molecular FormulaC21H25IN4O2
  • Average mass492.353 Da
  • Monoisotopic mass492.102203 Da
  • ChemSpider ID31606515

More details:

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

Benzamide, N-[2-[[[6-(hexahydro-1H-azepin-1-yl)-3-pyridinyl]methyl]amino]-2-oxoethyl]-2-iodo- [ACD/Index Name]
N-[2-({[6-(1-Azepanyl)-3-pyridinyl]methyl}amino)-2-oxoethyl]-2-iodbenzamid [German] [ACD/IUPAC Name]
N-[2-({[6-(1-Azepanyl)-3-pyridinyl]methyl}amino)-2-oxoethyl]-2-iodobenzamide [ACD/IUPAC Name]
N-[2-({[6-(1-Azépanyl)-3-pyridinyl]méthyl}amino)-2-oxoéthyl]-2-iodobenzamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 723.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.7±3.0 kJ/mol
Flash Point: 391.3±32.9 °C
Index of Refraction: 1.621
Molar Refractivity: 117.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.95
ACD/LogD (pH 5.5): 1.52
ACD/BCF (pH 5.5): 3.99
ACD/KOC (pH 5.5): 38.66
ACD/LogD (pH 7.4): 2.76
ACD/BCF (pH 7.4): 69.86
ACD/KOC (pH 7.4): 676.30
Polar Surface Area: 74 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 54.5±3.0 dyne/cm
Molar Volume: 334.7±3.0 cm3

Click to predict properties on the Chemicalize site


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