ChemSpider 2D Image | 2-Methyl-2-propanyl 5-[(Z)-({[6-cyclopropyl-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-4-yl]carbonyl}hydrazono)methyl]-1H-indazole-1-carboxylate | C30H28FN7O3

2-Methyl-2-propanyl 5-[(Z)-({[6-cyclopropyl-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-4-yl]carbonyl}hydrazono)methyl]-1H-indazole-1-carboxylate

  • Molecular FormulaC30H28FN7O3
  • Average mass553.587 Da
  • Monoisotopic mass553.223755 Da
  • ChemSpider ID101393115

  • Double-bond stereo - Double-bond stereo

More details:

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

1H-Pyrazolo[3,4-b]pyridine-4-carboxylic acid, 6-cyclopropyl-1-(4-fluorophenyl)-3-methyl-, 2-[(1Z)-[1-[(1,1-dimethylethoxy)carbonyl]-1H-indazol-5-yl]methylene]hydrazide [ACD/Index Name]
2-Methyl-2-propanyl 5-[(Z)-({[6-cyclopropyl-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-4-yl]carbonyl}hydrazono)methyl]-1H-indazole-1-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-5-[(Z)-({[6-cyclopropyl-1-(4-fluorphenyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-4-yl]carbonyl}hydrazono)methyl]-1H-indazol-1-carboxylat [German] [ACD/IUPAC Name]
5-[(Z)-({[6-Cyclopropyl-1-(4-fluorophényl)-3-méthyl-1H-pyrazolo[3,4-b]pyridin-4-yl]carbonyl}hydrazono)méthyl]-1H-indazole-1-carboxylate de 2-méthyl-2-propanyle [French] [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: 1.694
Molar Refractivity: 151.5±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: 5.66
ACD/LogD (pH 5.5): 4.75
ACD/BCF (pH 5.5): 2383.94
ACD/KOC (pH 5.5): 9100.03
ACD/LogD (pH 7.4): 4.74
ACD/BCF (pH 7.4): 2366.87
ACD/KOC (pH 7.4): 9034.86
Polar Surface Area: 116 Å2
Polarizability: 60.0±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 394.5±7.0 cm3

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