ChemSpider 2D Image | N'-{(Z)-[4-Chloro-2-(methylsulfonyl)phenyl]methylene}-2-(1-methyl-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)acetohydrazide | C16H15ClN6O4S

N'-{(Z)-[4-Chloro-2-(methylsulfonyl)phenyl]methylene}-2-(1-methyl-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)acetohydrazide

  • Molecular FormulaC16H15ClN6O4S
  • Average mass422.846 Da
  • Monoisotopic mass422.056396 Da
  • ChemSpider ID101415053

  • Double-bond stereo - Double-bond stereo

More details:

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

5H-Pyrazolo[3,4-d]pyrimidine-5-acetic acid, 1,4-dihydro-1-methyl-4-oxo-, 2-[(1Z)-[4-chloro-2-(methylsulfonyl)phenyl]methylene]hydrazide [ACD/Index Name]
N'-{(Z)-[4-Chlor-2-(methylsulfonyl)phenyl]methylen}-2-(1-methyl-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)acetohydrazid [German] [ACD/IUPAC Name]
N'-{(Z)-[4-Chloro-2-(methylsulfonyl)phenyl]methylene}-2-(1-methyl-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)acetohydrazide [ACD/IUPAC Name]
N'-{(Z)-[4-Chloro-2-(méthylsulfonyl)phényl]méthylène}-2-(1-méthyl-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)acétohydrazide [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: 1.710
Molar Refractivity: 104.5±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 0.60
ACD/LogD (pH 5.5): 0.61
ACD/BCF (pH 5.5): 1.70
ACD/KOC (pH 5.5): 50.91
ACD/LogD (pH 7.4): 0.61
ACD/BCF (pH 7.4): 1.70
ACD/KOC (pH 7.4): 50.90
Polar Surface Area: 134 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 65.7±7.0 dyne/cm
Molar Volume: 267.4±7.0 cm3

Click to predict properties on the Chemicalize site


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