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Search term: CTHMRJYHFQZMQB-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 5-[4-(2-Fluorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-isopropyl-N-methylbenzenesulfonamide | C18H19FN4O5S

5-[4-(2-Fluorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-isopropyl-N-methylbenzenesulfonamide

  • Molecular FormulaC18H19FN4O5S
  • Average mass422.431 Da
  • Monoisotopic mass422.106018 Da
  • ChemSpider ID76741819

More details:

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

5-[4-(2-Fluorophenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-isopropyl-N-methylbenzenesulfonamide [ACD/IUPAC Name]
5-[4-(2-Fluorophényl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-isopropyl-N-méthylbenzènesulfonamide [French] [ACD/IUPAC Name]
5-[4-(2-Fluorphenyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-isopropyl-N-methylbenzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, 5-[4-(2-fluorophenyl)-4,5-dihydro-5-oxo-1H-1,2,4-triazol-3-yl]-2,4-dihydroxy-N-methyl-N-(1-methylethyl)- [ACD/Index 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: 1.661
Molar Refractivity: 103.5±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.70
ACD/LogD (pH 5.5): 0.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.74
ACD/LogD (pH 7.4): -0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.82
Polar Surface Area: 131 Å2
Polarizability: 41.0±0.5 10-24cm3
Surface Tension: 56.7±7.0 dyne/cm
Molar Volume: 280.1±7.0 cm3

Click to predict properties on the Chemicalize site


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