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Search term: DQBMNFHBBWKDOU (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 4,4,4-Trifluoro-3-hydroxy-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(4-methyl-1,3-thiazol-2-yl)butanamide | C17H19F3N2O4S

4,4,4-Trifluoro-3-hydroxy-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(4-methyl-1,3-thiazol-2-yl)butanamide

  • Molecular FormulaC17H19F3N2O4S
  • Average mass404.404 Da
  • Monoisotopic mass404.101776 Da
  • ChemSpider ID34314111

More details:






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

2-Thiazolepropanamide, β-hydroxy-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-4-methyl-β-(trifluoromethyl)- [ACD/Index Name]
4,4,4-Trifluor-3-hydroxy-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(4-methyl-1,3-thiazol-2-yl)butanamid [German] [ACD/IUPAC Name]
4,4,4-Trifluoro-3-hydroxy-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(4-methyl-1,3-thiazol-2-yl)butanamide [ACD/IUPAC Name]
4,4,4-Trifluoro-3-hydroxy-N-[2-hydroxy-2-(4-méthoxyphényl)éthyl]-3-(4-méthyl-1,3-thiazol-2-yl)butanamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 616.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.1±3.0 kJ/mol
Flash Point: 326.6±31.5 °C
Index of Refraction: 1.556
Molar Refractivity: 93.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.02
ACD/LogD (pH 5.5): 3.48
ACD/BCF (pH 5.5): 259.29
ACD/KOC (pH 5.5): 1859.31
ACD/LogD (pH 7.4): 3.47
ACD/BCF (pH 7.4): 256.16
ACD/KOC (pH 7.4): 1836.86
Polar Surface Area: 120 Å2
Polarizability: 37.1±0.5 10-24cm3
Surface Tension: 48.4±3.0 dyne/cm
Molar Volume: 290.9±3.0 cm3

Click to predict properties on the Chemicalize site






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