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Search term: WQSFFIUNHUNRCQ-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 2-{[(3-Chloro-4-phenoxy-2-pyridinyl)methyl]sulfinyl}-1H-thieno[3,4-d]imidazole | C17H12ClN3O2S2

2-{[(3-Chloro-4-phenoxy-2-pyridinyl)methyl]sulfinyl}-1H-thieno[3,4-d]imidazole

  • Molecular FormulaC17H12ClN3O2S2
  • Average mass389.879 Da
  • Monoisotopic mass389.005951 Da
  • ChemSpider ID23215424

More details:

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

1H-Thieno[3,4-d]imidazole, 2-[[(3-chloro-4-phenoxy-2-pyridinyl)methyl]sulfinyl]- [ACD/Index Name]
2-{[(3-Chlor-4-phenoxy-2-pyridinyl)methyl]sulfinyl}-1H-thieno[3,4-d]imidazol [German] [ACD/IUPAC Name]
2-{[(3-Chloro-4-phenoxy-2-pyridinyl)methyl]sulfinyl}-1H-thieno[3,4-d]imidazole [ACD/IUPAC Name]
2-{[(3-Chloro-4-phénoxy-2-pyridinyl)méthyl]sulfinyl}-1H-thiéno[3,4-d]imidazole [French] [ACD/IUPAC Name]
2-{[(3-chloro-4-phenoxypyridin-2-yl)methyl]sulfinyl}-1H-thieno[3,4-d]imidazole
2-(3-Chloro-4-phenoxy-pyridin-2-ylmethanesulfinyl)-3H-thieno[3,4-d]imidazole

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

Density: 1.6±0.1 g/cm3
Boiling Point: 620.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.9±3.0 kJ/mol
Flash Point: 328.8±34.3 °C
Index of Refraction: 1.777
Molar Refractivity: 101.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.72
ACD/LogD (pH 5.5): 3.51
ACD/BCF (pH 5.5): 273.28
ACD/KOC (pH 5.5): 1929.22
ACD/LogD (pH 7.4): 3.51
ACD/BCF (pH 7.4): 273.09
ACD/KOC (pH 7.4): 1927.89
Polar Surface Area: 115 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 97.6±5.0 dyne/cm
Molar Volume: 242.5±5.0 cm3

Click to predict properties on the Chemicalize site


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