ChemSpider 2D Image | Methyl N-{[3-(2-fluoro-4-methoxyphenyl)-6-oxo-1(6H)-pyridazinyl]acetyl}-beta-alaninate | C17H18FN3O5

Methyl N-{[3-(2-fluoro-4-methoxyphenyl)-6-oxo-1(6H)-pyridazinyl]acetyl}-β-alaninate

  • Molecular FormulaC17H18FN3O5
  • Average mass363.340 Da
  • Monoisotopic mass363.123047 Da
  • ChemSpider ID32512867

More details:

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

Methyl N-{[3-(2-fluoro-4-methoxyphenyl)-6-oxo-1(6H)-pyridazinyl]acetyl}-β-alaninate [ACD/IUPAC Name]
Methyl-N-{[3-(2-fluor-4-methoxyphenyl)-6-oxo-1(6H)-pyridazinyl]acetyl}-β-alaninat [German] [ACD/IUPAC Name]
N-{2-[3-(2-Fluoro-4-méthoxyphényl)-6-oxo-1(6H)-pyridazinyl]acétyl}-β-alaninate de méthyle [French] [ACD/IUPAC Name]
β-Alanine, N-[2-[3-(2-fluoro-4-methoxyphenyl)-6-oxo-1(6H)-pyridazinyl]acetyl]-, methyl ester [ACD/Index Name]
1630865-55-2 [RN]
3-{2-[3-(2-Fluoro-4-methoxy-phenyl)-6-oxo-6H-pyridazin-1-yl]-acetylamino}-propionic acid methyl ester
methyl 3-[[2-[3-(2-fluoro-4-methoxyphenyl)-6-oxopyridazin-1-yl]acetyl]amino]propanoate
METHYL 3-{2-[3-(2-FLUORO-4-METHOXYPHENYL)-6-OXOPYRIDAZIN-1-YL]ACETAMIDO}PROPANOATE
methyl N-{[3-(2-fluoro-4-methoxyphenyl)-6-oxopyridazin-1(6H)-yl]acetyl}-β-alaninate

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

    Density: 1.3±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.573
    Molar Refractivity: 90.7±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: -0.10
    ACD/LogD (pH 5.5): 0.29
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 34.40
    ACD/LogD (pH 7.4): 0.29
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 34.40
    Polar Surface Area: 97 Å2
    Polarizability: 36.0±0.5 10-24cm3
    Surface Tension: 45.5±7.0 dyne/cm
    Molar Volume: 275.4±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement