ChemSpider 2D Image | N-{[2-(2-{[(3-Fluorophenyl)sulfonyl]amino}phenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-2-(1H-1,2,4-triazol-1-yl)propanamide | C22H21FN6O4S

N-{[2-(2-{[(3-Fluorophenyl)sulfonyl]amino}phenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-2-(1H-1,2,4-triazol-1-yl)propanamide

  • Molecular FormulaC22H21FN6O4S
  • Average mass484.503 Da
  • Monoisotopic mass484.132904 Da
  • ChemSpider ID22197647

More details:

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

1H-1,2,4-Triazole-1-acetamide, N-[[2-[2-[[(3-fluorophenyl)sulfonyl]amino]phenyl]-5-methyl-4-oxazolyl]methyl]-α-methyl- [ACD/Index Name]
N-{[2-(2-{[(3-Fluorophenyl)sulfonyl]amino}phenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-2-(1H-1,2,4-triazol-1-yl)propanamide [ACD/IUPAC Name]
N-{[2-(2-{[(3-Fluorophényl)sulfonyl]amino}phényl)-5-méthyl-1,3-oxazol-4-yl]méthyl}-2-(1H-1,2,4-triazol-1-yl)propanamide [French] [ACD/IUPAC Name]
N-{[2-(2-{[(3-Fluorphenyl)sulfonyl]amino}phenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-2-(1H-1,2,4-triazol-1-yl)propanamid [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: 1.673
Molar Refractivity: 124.5±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.70
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 15.61
ACD/KOC (pH 5.5): 247.83
ACD/LogD (pH 7.4): 1.57
ACD/BCF (pH 7.4): 7.75
ACD/KOC (pH 7.4): 123.10
Polar Surface Area: 140 Å2
Polarizability: 49.3±0.5 10-24cm3
Surface Tension: 56.2±7.0 dyne/cm
Molar Volume: 331.9±7.0 cm3

Click to predict properties on the Chemicalize site


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