ChemSpider 2D Image | Methyl N-{4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]butanoyl}methioninate | C18H22FN3O4S

Methyl N-{4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]butanoyl}methioninate

  • Molecular FormulaC18H22FN3O4S
  • Average mass395.448 Da
  • Monoisotopic mass395.131500 Da
  • ChemSpider ID24758360

More details:

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

Methionine, N-[4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1-oxobutyl]-, methyl ester [ACD/Index Name]
Methyl N-{4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]butanoyl}methioninate [ACD/IUPAC Name]
Methyl-N-{4-[3-(4-fluorphenyl)-1,2,4-oxadiazol-5-yl]butanoyl}methioninat [German] [ACD/IUPAC Name]
N-{4-[3-(4-Fluorophényl)-1,2,4-oxadiazol-5-yl]butanoyl}méthioninate de méthyle [French] [ACD/IUPAC Name]
methyl 2-(4-(3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl)butanamido)-4-(methylthio)butanoate
methyl 2-{4-[3-(4-fluorophenyl)(1,2,4-oxadiazol-5-yl)]butanoylamino}-4-methylthiobutanoate
methyl 2-{4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]butanamido}-4-(methylsulfanyl)butanoate

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.539
Molar Refractivity: 99.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 2.96
ACD/LogD (pH 5.5): 2.71
ACD/BCF (pH 5.5): 67.43
ACD/KOC (pH 5.5): 709.12
ACD/LogD (pH 7.4): 2.71
ACD/BCF (pH 7.4): 67.43
ACD/KOC (pH 7.4): 709.12
Polar Surface Area: 120 Å2
Polarizability: 39.4±0.5 10-24cm3
Surface Tension: 47.3±3.0 dyne/cm
Molar Volume: 316.8±3.0 cm3

Click to predict properties on the Chemicalize site


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