ChemSpider 2D Image | 2-[(4-Chlorophenoxy)methyl]-5-{[2-(4-morpholinyl)-2-phenylethyl]amino}-1,3-oxazole-4-carbonitrile | C23H23ClN4O3

2-[(4-Chlorophenoxy)methyl]-5-{[2-(4-morpholinyl)-2-phenylethyl]amino}-1,3-oxazole-4-carbonitrile

  • Molecular FormulaC23H23ClN4O3
  • Average mass438.907 Da
  • Monoisotopic mass438.145874 Da
  • ChemSpider ID21606699

More details:

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

2-[(4-Chlorophenoxy)methyl]-5-{[2-(4-morpholinyl)-2-phenylethyl]amino}-1,3-oxazole-4-carbonitrile [ACD/IUPAC Name]
2-[(4-Chlorophénoxy)méthyl]-5-{[2-(4-morpholinyl)-2-phényléthyl]amino}-1,3-oxazole-4-carbonitrile [French] [ACD/IUPAC Name]
2-[(4-chlorophenoxy)methyl]-5-{[2-(morpholin-4-yl)-2-phenylethyl]amino}-1,3-oxazole-4-carbonitrile
2-[(4-Chlorphenoxy)methyl]-5-{[2-(4-morpholinyl)-2-phenylethyl]amino}-1,3-oxazol-4-carbonitril [German] [ACD/IUPAC Name]
4-Oxazolecarbonitrile, 2-[(4-chlorophenoxy)methyl]-5-[[2-(4-morpholinyl)-2-phenylethyl]amino]- [ACD/Index Name]
2-[(4-chlorophenoxy)methyl]-5-[(2-morpholin-4-yl-2-phenylethyl)amino]-1,3-oxazole-4-carbonitrile
905768-83-4 [RN]
AGN-PC-06VT5W
AKOS002289641
AKOS016329260
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 643.7±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 95.0±3.0 kJ/mol
    Flash Point: 343.1±31.5 °C
    Index of Refraction: 1.636
    Molar Refractivity: 117.2±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 3.36
    ACD/LogD (pH 5.5): 3.03
    ACD/BCF (pH 5.5): 94.94
    ACD/KOC (pH 5.5): 699.74
    ACD/LogD (pH 7.4): 3.42
    ACD/BCF (pH 7.4): 231.16
    ACD/KOC (pH 7.4): 1703.77
    Polar Surface Area: 84 Å2
    Polarizability: 46.5±0.5 10-24cm3
    Surface Tension: 65.4±5.0 dyne/cm
    Molar Volume: 326.8±5.0 cm3

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