ChemSpider 2D Image | Methyl 4-chloro-3-({5-[(3-methoxypropyl)carbamoyl]-1,2,4-oxadiazol-3-yl}methyl)benzoate | C16H18ClN3O5

Methyl 4-chloro-3-({5-[(3-methoxypropyl)carbamoyl]-1,2,4-oxadiazol-3-yl}methyl)benzoate

  • Molecular FormulaC16H18ClN3O5
  • Average mass367.784 Da
  • Monoisotopic mass367.093506 Da
  • ChemSpider ID27327869

More details:

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

4-Chloro-3-({5-[(3-méthoxypropyl)carbamoyl]-1,2,4-oxadiazol-3-yl}méthyl)benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-chloro-3-[[5-[[(3-methoxypropyl)amino]carbonyl]-1,2,4-oxadiazol-3-yl]methyl]-, methyl ester [ACD/Index Name]
Methyl 4-chloro-3-({5-[(3-methoxypropyl)carbamoyl]-1,2,4-oxadiazol-3-yl}methyl)benzoate [ACD/IUPAC Name]
Methyl-4-chlor-3-({5-[(3-methoxypropyl)carbamoyl]-1,2,4-oxadiazol-3-yl}methyl)benzoat [German] [ACD/IUPAC Name]
1246073-90-4 [RN]
4-Chloro-3-[5-(3-methoxy-propylcarbamoyl)-[1,2,4]oxadiazol-3-ylmethyl]-benzoic acid methyl ester
methyl 4-chloro-3-((5-((3-methoxypropyl)carbamoyl)-1,2,4-oxadiazol-3-yl)methyl)benzoate
methyl 4-chloro-3-[[5-(3-methoxypropylcarbamoyl)-1,2,4-oxadiazol-3-yl]methyl]benzoate

    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: 1.546
    Molar Refractivity: 90.0±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 1.75
    ACD/LogD (pH 5.5): 2.11
    ACD/BCF (pH 5.5): 23.61
    ACD/KOC (pH 5.5): 334.59
    ACD/LogD (pH 7.4): 2.11
    ACD/BCF (pH 7.4): 23.61
    ACD/KOC (pH 7.4): 334.59
    Polar Surface Area: 104 Å2
    Polarizability: 35.7±0.5 10-24cm3
    Surface Tension: 49.4±3.0 dyne/cm
    Molar Volume: 284.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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