ChemSpider 2D Image | Methyl 4-chloro-2-[({3-[2-(4-pyridinyl)-3H-imidazo[4,5-b]pyridin-3-yl]propyl}carbamoyl)amino]benzoate | C23H21ClN6O3

Methyl 4-chloro-2-[({3-[2-(4-pyridinyl)-3H-imidazo[4,5-b]pyridin-3-yl]propyl}carbamoyl)amino]benzoate

  • Molecular FormulaC23H21ClN6O3
  • Average mass464.904 Da
  • Monoisotopic mass464.136353 Da
  • ChemSpider ID23003337

More details:






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

4-Chloro-2-[({3-[2-(4-pyridinyl)-3H-imidazo[4,5-b]pyridin-3-yl]propyl}carbamoyl)amino]benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-chloro-2-[[[[3-[2-(4-pyridinyl)-3H-imidazo[4,5-b]pyridin-3-yl]propyl]amino]carbonyl]amino]-, methyl ester [ACD/Index Name]
Methyl 4-chloro-2-[({3-[2-(4-pyridinyl)-3H-imidazo[4,5-b]pyridin-3-yl]propyl}carbamoyl)amino]benzoate [ACD/IUPAC Name]
Methyl-4-chlor-2-[({3-[2-(4-pyridinyl)-3H-imidazo[4,5-b]pyridin-3-yl]propyl}carbamoyl)amino]benzoat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.677
Molar Refractivity: 125.1±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.80
ACD/LogD (pH 5.5): 3.96
ACD/BCF (pH 5.5): 606.12
ACD/KOC (pH 5.5): 3405.52
ACD/LogD (pH 7.4): 3.97
ACD/BCF (pH 7.4): 611.83
ACD/KOC (pH 7.4): 3437.61
Polar Surface Area: 111 Å2
Polarizability: 49.6±0.5 10-24cm3
Surface Tension: 55.8±7.0 dyne/cm
Molar Volume: 332.3±7.0 cm3

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