ChemSpider 2D Image | Ethyl 4-({5-[(2-chlorobenzoyl)amino]-1-ethyl-1H-benzimidazol-2-yl}methyl)-1-piperazinecarboxylate | C24H28ClN5O3

Ethyl 4-({5-[(2-chlorobenzoyl)amino]-1-ethyl-1H-benzimidazol-2-yl}methyl)-1-piperazinecarboxylate

  • Molecular FormulaC24H28ClN5O3
  • Average mass469.964 Da
  • Monoisotopic mass469.188080 Da
  • ChemSpider ID21907240

More details:

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

1-Piperazinecarboxylic acid, 4-[[5-[(2-chlorobenzoyl)amino]-1-ethyl-1H-benzimidazol-2-yl]methyl]-, ethyl ester [ACD/Index Name]
4-({5-[(2-Chlorobenzoyl)amino]-1-éthyl-1H-benzimidazol-2-yl}méthyl)-1-pipérazinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-({5-[(2-chlorobenzoyl)amino]-1-ethyl-1H-benzimidazol-2-yl}methyl)-1-piperazinecarboxylate [ACD/IUPAC Name]
Ethyl-4-({5-[(2-chlorbenzoyl)amino]-1-ethyl-1H-benzimidazol-2-yl}methyl)-1-piperazincarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 590.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.1±3.0 kJ/mol
Flash Point: 310.8±30.1 °C
Index of Refraction: 1.642
Molar Refractivity: 128.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.61
ACD/LogD (pH 5.5): 2.95
ACD/BCF (pH 5.5): 81.03
ACD/KOC (pH 5.5): 604.94
ACD/LogD (pH 7.4): 3.39
ACD/BCF (pH 7.4): 220.10
ACD/KOC (pH 7.4): 1643.28
Polar Surface Area: 80 Å2
Polarizability: 50.8±0.5 10-24cm3
Surface Tension: 50.9±7.0 dyne/cm
Molar Volume: 354.9±7.0 cm3

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