ChemSpider 2D Image | Pyrazolam | C16H12BrN5

Pyrazolam

  • Molecular FormulaC16H12BrN5
  • Average mass354.204 Da
  • Monoisotopic mass353.027588 Da
  • ChemSpider ID15417688

More details:






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

39243-02-2 [RN]
4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine, 8-bromo-1-methyl-6-(2-pyridinyl)- [ACD/Index Name]
8-Brom-1-methyl-6-(2-pyridinyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin [German] [ACD/IUPAC Name]
8-Bromo-1-methyl-6-(2-pyridinyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine [ACD/IUPAC Name]
8-Bromo-1-méthyl-6-(2-pyridinyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazépine [French] [ACD/IUPAC Name]
8LH16383PK
Pyrazolam [Wiki]
12-bromo-3-methyl-9-(pyridin-2-yl)-2,4,5,8-tetraazatricyclo[8.4.0.0,2,6]tetradeca-1(10),3,5,8,11,13-hexaene
8-bromo-1-methyl-6-(2-pyridyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
8bromo-1-methyl-6-(2-pyridyl)-4H-s-triazolo[4,3-a][1,4]benzodiazepine
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 544.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.3±3.0 kJ/mol
Flash Point: 283.0±32.9 °C
Index of Refraction: 1.762
Molar Refractivity: 89.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.93
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 15.86
ACD/KOC (pH 5.5): 251.52
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 15.88
ACD/KOC (pH 7.4): 251.92
Polar Surface Area: 56 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 58.8±7.0 dyne/cm
Molar Volume: 217.5±7.0 cm3

Click to predict properties on the Chemicalize site





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