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Search term: PRDJGQAKGYALKD (Found by InChIKey (skeleton match))
ChemSpider 2D Image | N-[2-(5-Chloro-1H-benzimidazol-2-yl)ethyl]-N'-ethyl-1-isobutyl-4-oxo-1,4-dihydro-3,5-pyridinedicarboxamide | C22H26ClN5O3

N-[2-(5-Chloro-1H-benzimidazol-2-yl)ethyl]-N'-ethyl-1-isobutyl-4-oxo-1,4-dihydro-3,5-pyridinedicarboxamide

  • Molecular FormulaC22H26ClN5O3
  • Average mass443.927 Da
  • Monoisotopic mass443.172424 Da
  • ChemSpider ID22153117

More details:

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

3,5-Pyridinedicarboxamide, N3-[2-(5-chloro-1H-benzimidazol-2-yl)ethyl]-N5-ethyl-1,4-dihydro-1-(2-methylpropyl)-4-oxo- [ACD/Index Name]
N-[2-(5-Chlor-1H-benzimidazol-2-yl)ethyl]-N'-ethyl-1-isobutyl-4-oxo-1,4-dihydro-3,5-pyridindicarboxamid [German] [ACD/IUPAC Name]
N-[2-(5-Chloro-1H-benzimidazol-2-yl)ethyl]-N'-ethyl-1-isobutyl-4-oxo-1,4-dihydro-3,5-pyridinedicarboxamide [ACD/IUPAC Name]
N-[2-(5-Chloro-1H-benzimidazol-2-yl)éthyl]-N'-éthyl-1-isobutyl-4-oxo-1,4-dihydro-3,5-pyridinedicarboxamide [French] [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: 764.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.3±3.0 kJ/mol
Flash Point: 415.9±32.9 °C
Index of Refraction: 1.620
Molar Refractivity: 119.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.09
ACD/LogD (pH 5.5): 1.11
ACD/BCF (pH 5.5): 3.94
ACD/KOC (pH 5.5): 87.75
ACD/LogD (pH 7.4): 1.20
ACD/BCF (pH 7.4): 4.80
ACD/KOC (pH 7.4): 106.90
Polar Surface Area: 107 Å2
Polarizability: 47.2±0.5 10-24cm3
Surface Tension: 58.7±3.0 dyne/cm
Molar Volume: 339.0±3.0 cm3

Click to predict properties on the Chemicalize site


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