ChemSpider 2D Image | 6-Cyclopropyl-N'-[(Z)-{2-hydroxy-4-[3-(trifluoromethyl)-3H-diaziren-3-yl]phenyl}methylene]-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide | C26H20F3N7O2

6-Cyclopropyl-N'-[(Z)-{2-hydroxy-4-[3-(trifluoromethyl)-3H-diaziren-3-yl]phenyl}methylene]-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide

  • Molecular FormulaC26H20F3N7O2
  • Average mass519.478 Da
  • Monoisotopic mass519.163086 Da
  • ChemSpider ID103260053

  • 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-3-methyl-1-phenyl-, 2-[(1Z)-[2-hydroxy-4-[3-(trifluoromethyl)-3H-diazirin-3-yl]phenyl]methylene]hydrazide [ACD/Index Name]
6-Cyclopropyl-N'-[(Z)-{2-hydroxy-4-[3-(trifluormethyl)-3H-diaziren-3-yl]phenyl}methylen]-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-4-carbohydrazid [German] [ACD/IUPAC Name]
6-Cyclopropyl-N'-[(Z)-{2-hydroxy-4-[3-(trifluoromethyl)-3H-diaziren-3-yl]phenyl}methylene]-3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide [ACD/IUPAC Name]
6-Cyclopropyl-N'-[(Z)-{2-hydroxy-4-[3-(trifluorométhyl)-3H-diazirén-3-yl]phényl}méthylène]-3-méthyl-1-phényl-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.724
Molar Refractivity: 131.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 7.33
ACD/LogD (pH 5.5): 4.77
ACD/BCF (pH 5.5): 2478.89
ACD/KOC (pH 5.5): 9350.26
ACD/LogD (pH 7.4): 4.68
ACD/BCF (pH 7.4): 2020.82
ACD/KOC (pH 7.4): 7622.47
Polar Surface Area: 117 Å2
Polarizability: 52.2±0.5 10-24cm3
Surface Tension: 58.3±7.0 dyne/cm
Molar Volume: 331.6±7.0 cm3

Click to predict properties on the Chemicalize site


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