ChemSpider 2D Image | 5-(4-Cyano-5-{[3-(4-morpholinyl)propyl]amino}-1,3-oxazol-2-yl)-2-methoxy-N,N-dimethylbenzenesulfonamide | C20H27N5O5S

5-(4-Cyano-5-{[3-(4-morpholinyl)propyl]amino}-1,3-oxazol-2-yl)-2-methoxy-N,N-dimethylbenzenesulfonamide

  • Molecular FormulaC20H27N5O5S
  • Average mass449.524 Da
  • Monoisotopic mass449.173279 Da
  • ChemSpider ID21771490

More details:

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

5-(4-Cyan-5-{[3-(4-morpholinyl)propyl]amino}-1,3-oxazol-2-yl)-2-methoxy-N,N-dimethylbenzolsulfonamid [German] [ACD/IUPAC Name]
5-(4-Cyano-5-{[3-(4-morpholinyl)propyl]amino}-1,3-oxazol-2-yl)-2-methoxy-N,N-dimethylbenzenesulfonamide [ACD/IUPAC Name]
5-(4-Cyano-5-{[3-(4-morpholinyl)propyl]amino}-1,3-oxazol-2-yl)-2-méthoxy-N,N-diméthylbenzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 5-[4-cyano-5-[[3-(4-morpholinyl)propyl]amino]-2-oxazolyl]-2-methoxy-N,N-dimethyl- [ACD/Index Name]
5-(4-cyano-5-{[3-(morpholin-4-yl)propyl]amino}-1,3-oxazol-2-yl)-2-methoxy-N,N-dimethylbenzenesulfonamide
5-[4-cyano-5-(3-morpholin-4-ylpropylamino)-1,3-oxazol-2-yl]-2-methoxy-N,N-dimethylbenzenesulfonamide
951964-63-9 [RN]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 685.2±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 100.5±3.0 kJ/mol
    Flash Point: 368.2±34.3 °C
    Index of Refraction: 1.610
    Molar Refractivity: 114.3±0.4 cm3
    #H bond acceptors: 10
    #H bond donors: 1
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 1
    ACD/LogP: 1.00
    ACD/LogD (pH 5.5): -0.82
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.40
    ACD/LogD (pH 7.4): 0.67
    ACD/BCF (pH 7.4): 1.69
    ACD/KOC (pH 7.4): 43.84
    Polar Surface Area: 129 Å2
    Polarizability: 45.3±0.5 10-24cm3
    Surface Tension: 67.0±5.0 dyne/cm
    Molar Volume: 329.5±5.0 cm3

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