ChemSpider 2D Image | N-(3-Chlorobenzyl)-3-{[(2-methyl-4-oxo-4H-pyran-3-yl)oxy]methyl}-1,2,4-oxadiazole-5-carboxamide | C17H14ClN3O5

N-(3-Chlorobenzyl)-3-{[(2-methyl-4-oxo-4H-pyran-3-yl)oxy]methyl}-1,2,4-oxadiazole-5-carboxamide

  • Molecular FormulaC17H14ClN3O5
  • Average mass375.763 Da
  • Monoisotopic mass375.062195 Da
  • ChemSpider ID23494185

More details:

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

1,2,4-Oxadiazole-5-carboxamide, N-[(3-chlorophenyl)methyl]-3-[[(2-methyl-4-oxo-4H-pyran-3-yl)oxy]methyl]- [ACD/Index Name]
N-(3-Chlorbenzyl)-3-{[(2-methyl-4-oxo-4H-pyran-3-yl)oxy]methyl}-1,2,4-oxadiazol-5-carboxamid [German] [ACD/IUPAC Name]
N-(3-Chlorobenzyl)-3-{[(2-methyl-4-oxo-4H-pyran-3-yl)oxy]methyl}-1,2,4-oxadiazole-5-carboxamide [ACD/IUPAC Name]
N-(3-Chlorobenzyl)-3-{[(2-méthyl-4-oxo-4H-pyran-3-yl)oxy]méthyl}-1,2,4-oxadiazole-5-carboxamide [French] [ACD/IUPAC Name]
1144454-18-1 [RN]
3-(2-Methyl-4-oxo-4H-pyran-3-yloxymethyl)-[1,2,4]oxadiazole-5-carboxylic acid 3-chloro-benzylamide
N-[(3-chlorophenyl)methyl]-3-[(2-methyl-4-oxopyran-3-yl)oxymethyl]-1,2,4-oxadiazole-5-carboxamide

    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: 1.623
    Molar Refractivity: 90.7±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.01
    ACD/LogD (pH 5.5): 1.50
    ACD/BCF (pH 5.5): 8.16
    ACD/KOC (pH 5.5): 156.38
    ACD/LogD (pH 7.4): 1.50
    ACD/BCF (pH 7.4): 8.16
    ACD/KOC (pH 7.4): 156.37
    Polar Surface Area: 104 Å2
    Polarizability: 36.0±0.5 10-24cm3
    Surface Tension: 67.6±5.0 dyne/cm
    Molar Volume: 257.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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