ChemSpider 2D Image | N-[5-(Methoxymethyl)-1,3,4-thiadiazol-2-yl]-3-(3-methoxy-1,2-oxazol-5-yl)propanamide | C11H14N4O4S

N-[5-(Methoxymethyl)-1,3,4-thiadiazol-2-yl]-3-(3-methoxy-1,2-oxazol-5-yl)propanamide

  • Molecular FormulaC11H14N4O4S
  • Average mass298.318 Da
  • Monoisotopic mass298.073578 Da
  • ChemSpider ID29345242

More details:

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

5-Isoxazolepropanamide, 3-methoxy-N-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]- [ACD/Index Name]
N-[5-(Methoxymethyl)-1,3,4-thiadiazol-2-yl]-3-(3-methoxy-1,2-oxazol-5-yl)propanamid [German] [ACD/IUPAC Name]
N-[5-(Methoxymethyl)-1,3,4-thiadiazol-2-yl]-3-(3-methoxy-1,2-oxazol-5-yl)propanamide [ACD/IUPAC Name]
N-[5-(Méthoxyméthyl)-1,3,4-thiadiazol-2-yl]-3-(3-méthoxy-1,2-oxazol-5-yl)propanamide [French] [ACD/IUPAC Name]
1401582-85-1 [RN]
3-(3-Methoxy-isoxazol-5-yl)-N-(5-methoxymethyl-[1,3,4]thiadiazol-2-yl)-propionamide

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 461.2±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.2±3.0 kJ/mol
    Flash Point: 232.7±31.5 °C
    Index of Refraction: 1.644
    Molar Refractivity: 72.8±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: -0.08
    ACD/LogD (pH 5.5): 0.33
    ACD/BCF (pH 5.5): 1.05
    ACD/KOC (pH 5.5): 36.12
    ACD/LogD (pH 7.4): 0.33
    ACD/BCF (pH 7.4): 1.05
    ACD/KOC (pH 7.4): 36.12
    Polar Surface Area: 124 Å2
    Polarizability: 28.9±0.5 10-24cm3
    Surface Tension: 54.4±7.0 dyne/cm
    Molar Volume: 201.1±7.0 cm3

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