ChemSpider 2D Image | N'-[(Z)-{2-[(2-Chlorophenyl)sulfanyl]phenyl}methylene]-6-(1,5-dimethyl-1H-pyrazol-4-yl)-3-methyl-1-propyl-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide | C29H28ClN7OS

N'-[(Z)-{2-[(2-Chlorophenyl)sulfanyl]phenyl}methylene]-6-(1,5-dimethyl-1H-pyrazol-4-yl)-3-methyl-1-propyl-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide

  • Molecular FormulaC29H28ClN7OS
  • Average mass558.097 Da
  • Monoisotopic mass557.176453 Da
  • ChemSpider ID100808602

  • 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-(1,5-dimethyl-1H-pyrazol-4-yl)-3-methyl-1-propyl-, 2-[(1Z)-[2-[(2-chlorophenyl)thio]phenyl]methylene]hydrazide [ACD/Index Name]
N'-[(Z)-{2-[(2-Chlorophenyl)sulfanyl]phenyl}methylene]-6-(1,5-dimethyl-1H-pyrazol-4-yl)-3-methyl-1-propyl-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide [ACD/IUPAC Name]
N'-[(Z)-{2-[(2-Chlorophényl)sulfanyl]phényl}méthylène]-6-(1,5-diméthyl-1H-pyrazol-4-yl)-3-méthyl-1-propyl-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide [French] [ACD/IUPAC Name]
N'-[(Z)-{2-[(2-Chlorphenyl)sulfanyl]phenyl}methylen]-6-(1,5-dimethyl-1H-pyrazol-4-yl)-3-methyl-1-propyl-1H-pyrazolo[3,4-b]pyridin-4-carbohydrazid [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.685
Molar Refractivity: 159.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.28
ACD/LogD (pH 5.5): 5.78
ACD/BCF (pH 5.5): 14623.68
ACD/KOC (pH 5.5): 33336.51
ACD/LogD (pH 7.4): 5.78
ACD/BCF (pH 7.4): 14571.85
ACD/KOC (pH 7.4): 33218.35
Polar Surface Area: 115 Å2
Polarizability: 63.1±0.5 10-24cm3
Surface Tension: 51.3±7.0 dyne/cm
Molar Volume: 418.9±7.0 cm3

Click to predict properties on the Chemicalize site


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