ChemSpider 2D Image | 1-Benzyl-N-[(4-chloro-1-ethyl-1H-pyrazol-5-yl)methyl]-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide | C22H23ClN6O

1-Benzyl-N-[(4-chloro-1-ethyl-1H-pyrazol-5-yl)methyl]-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide

  • Molecular FormulaC22H23ClN6O
  • Average mass422.911 Da
  • Monoisotopic mass422.162201 Da
  • ChemSpider ID23722318

More details:

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

1-Benzyl-N-[(4-chlor-1-ethyl-1H-pyrazol-5-yl)methyl]-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-4-carboxamid [German] [ACD/IUPAC Name]
1-Benzyl-N-[(4-chloro-1-ethyl-1H-pyrazol-5-yl)methyl]-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide [ACD/IUPAC Name]
1-Benzyl-N-[(4-chloro-1-éthyl-1H-pyrazol-5-yl)méthyl]-3,6-diméthyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide [French] [ACD/IUPAC Name]
1H-Pyrazolo[3,4-b]pyridine-4-carboxamide, N-[(4-chloro-1-ethyl-1H-pyrazol-5-yl)methyl]-3,6-dimethyl-1-(phenylmethyl)- [ACD/Index Name]
[3,6-dimethyl-1-benzylpyrazolo[5,4-b]pyridin-4-yl]-N-[(4-chloro-1-ethylpyrazol-5-yl)methyl]carboxamide
1-Benzyl-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid (4-chloro-2-ethyl-2H-pyrazol-3-ylmethyl)-amide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 660.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.2±3.0 kJ/mol
Flash Point: 353.3±31.5 °C
Index of Refraction: 1.673
Molar Refractivity: 118.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.58
ACD/LogD (pH 5.5): 3.65
ACD/BCF (pH 5.5): 352.65
ACD/KOC (pH 5.5): 2316.70
ACD/LogD (pH 7.4): 3.65
ACD/BCF (pH 7.4): 353.00
ACD/KOC (pH 7.4): 2318.97
Polar Surface Area: 78 Å2
Polarizability: 47.1±0.5 10-24cm3
Surface Tension: 50.3±7.0 dyne/cm
Molar Volume: 316.9±7.0 cm3

Click to predict properties on the Chemicalize site


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