ChemSpider 2D Image | N-(1H-Benzimidazol-6-yl)-1-(3,4-dichlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine | C18H11Cl2N7

N-(1H-Benzimidazol-6-yl)-1-(3,4-dichlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

  • Molecular FormulaC18H11Cl2N7
  • Average mass396.233 Da
  • Monoisotopic mass395.045288 Da
  • ChemSpider ID125756822

More details:

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

1H-Pyrazolo[3,4-d]pyrimidin-4-amine, N-1H-benzimidazol-6-yl-1-(3,4-dichlorophenyl)- [ACD/Index Name]
N-(1H-Benzimidazol-6-yl)-1-(3,4-dichlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine [ACD/IUPAC Name]
N-(1H-Benzimidazol-6-yl)-1-(3,4-dichlorophényl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine [French] [ACD/IUPAC Name]
N-(1H-Benzimidazol-6-yl)-1-(3,4-dichlorphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amin [German] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 664.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.7±3.0 kJ/mol
Flash Point: 355.7±31.5 °C
Index of Refraction: 1.830
Molar Refractivity: 104.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.92
ACD/LogD (pH 5.5): 3.25
ACD/BCF (pH 5.5): 152.71
ACD/KOC (pH 5.5): 1082.63
ACD/LogD (pH 7.4): 3.50
ACD/BCF (pH 7.4): 267.39
ACD/KOC (pH 7.4): 1895.66
Polar Surface Area: 84 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 69.7±7.0 dyne/cm
Molar Volume: 237.4±7.0 cm3

Click to predict properties on the Chemicalize site


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