ChemSpider 2D Image | 7-Bromo-2-(4-pyridinyl)thieno[3,2-c]pyridin-4(5H)-one | C12H7BrN2OS

7-Bromo-2-(4-pyridinyl)thieno[3,2-c]pyridin-4(5H)-one

  • Molecular FormulaC12H7BrN2OS
  • Average mass307.166 Da
  • Monoisotopic mass305.946228 Da
  • ChemSpider ID26329487

More details:






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

7-Brom-2-(4-pyridinyl)thieno[3,2-c]pyridin-4(5H)-on [German] [ACD/IUPAC Name]
7-Bromo-2-(4-pyridinyl)thieno[3,2-c]pyridin-4(5H)-one [ACD/IUPAC Name]
7-Bromo-2-(4-pyridinyl)thiéno[3,2-c]pyridin-4(5H)-one [French] [ACD/IUPAC Name]
Thieno[3,2-c]pyridin-4(5H)-one, 7-bromo-2-(4-pyridinyl)- [ACD/Index Name]
10.1016/j.bmcl.2011.06.050
7-Bromo-2-Pyridin-4-Yl-5h-Thieno[3,2-C]pyridin-4-One
ZRL

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 561.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.5±3.0 kJ/mol
Flash Point: 293.6±30.1 °C
Index of Refraction: 1.698
Molar Refractivity: 70.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.80
ACD/LogD (pH 5.5): 2.17
ACD/BCF (pH 5.5): 24.67
ACD/KOC (pH 5.5): 319.39
ACD/LogD (pH 7.4): 2.29
ACD/BCF (pH 7.4): 32.28
ACD/KOC (pH 7.4): 418.02
Polar Surface Area: 70 Å2
Polarizability: 27.9±0.5 10-24cm3
Surface Tension: 63.6±3.0 dyne/cm
Molar Volume: 182.4±3.0 cm3

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