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Search term: QMDPRTOSNLYXIQ-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | Ethyl ({2-[(1,3-benzothiazol-2-ylcarbonyl)amino]-5-fluoro-3-thienyl}carbonyl)carbamate | C16H12FN3O4S2

Ethyl ({2-[(1,3-benzothiazol-2-ylcarbonyl)amino]-5-fluoro-3-thienyl}carbonyl)carbamate

  • Molecular FormulaC16H12FN3O4S2
  • Average mass393.413 Da
  • Monoisotopic mass393.025330 Da
  • ChemSpider ID129214499

More details:

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

({2-[(1,3-Benzothiazol-2-ylcarbonyl)amino]-5-fluoro-3-thiényl}carbonyl)carbamate d'éthyle [French] [ACD/IUPAC Name]
Carbamic acid, N-[[2-[(2-benzothiazolylcarbonyl)amino]-5-fluoro-3-thienyl]carbonyl]-, ethyl ester [ACD/Index Name]
Ethyl ({2-[(1,3-benzothiazol-2-ylcarbonyl)amino]-5-fluoro-3-thienyl}carbonyl)carbamate [ACD/IUPAC Name]
Ethyl-({2-[(1,3-benzothiazol-2-ylcarbonyl)amino]-5-fluor-3-thienyl}carbonyl)carbamat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.694
Molar Refractivity: 98.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.45
ACD/LogD (pH 5.5): 3.76
ACD/BCF (pH 5.5): 422.47
ACD/KOC (pH 5.5): 2636.54
ACD/LogD (pH 7.4): 3.73
ACD/BCF (pH 7.4): 394.02
ACD/KOC (pH 7.4): 2459.01
Polar Surface Area: 154 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 68.6±3.0 dyne/cm
Molar Volume: 255.7±3.0 cm3

Click to predict properties on the Chemicalize site


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