ChemSpider 2D Image | DES(6-FLUORO-1,2-BENZOXAZOLE)-2,4-DIFLUOROBENZOYL RISPERIDONE | C23H27F2N3O2

DES(6-FLUORO-1,2-BENZOXAZOLE)-2,4-DIFLUOROBENZOYL RISPERIDONE

  • Molecular FormulaC23H27F2N3O2
  • Average mass415.476 Da
  • Monoisotopic mass415.207123 Da
  • ChemSpider ID24021696

More details:

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

158697-67-7 [RN]
3-{2-[4-(2,4-Difluorbenzoyl)-1-piperidinyl]ethyl}-2-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-4-on [German] [ACD/IUPAC Name]
3-{2-[4-(2,4-Difluorobenzoyl)-1-piperidinyl]ethyl}-2-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-4-one [ACD/IUPAC Name]
3-{2-[4-(2,4-Difluorobenzoyl)-1-pipéridinyl]éthyl}-2-méthyl-6,7,8,9-tétrahydro-4H-pyrido[1,2-a]pyrimidin-4-one [French] [ACD/IUPAC Name]
4H-Pyrido[1,2-a]pyrimidin-4-one, 3-[2-[4-(2,4-difluorobenzoyl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-2-methyl- [ACD/Index Name]
DES(6-FLUORO-1,2-BENZOXAZOLE)-2,4-DIFLUOROBENZOYL RISPERIDONE
(2S)-2-(phenylcarbamoyloxy)propanoate
(2S)-2-[anilino(oxo)methoxy]propanoate
3-(2-[4-(2,4-DIFLUORO-BENZOYL)-PIPERIDIN-1-YL]-ETHYL)-2-METHYL-6,7,8,9-TETRAHYDRO-PYRIDO-[1,2-A]-PYRIMIDIN-4-ONE
3-?[2-?[4-?(2,?4-?difluorobenzoyl)?-?1-?piperidinyl]?ethyl]?-?6,?7,?8,?9-?tetrahydro-?2-?methyl-4H-?Pyrido[1,?2-?a]?pyrimidin-?4-?one
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

9JFX9B33TN [DBID]
UNII:9JFX9B33TN [DBID]
UNII-9JFX9B33TN [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 543.6±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 82.2±3.0 kJ/mol
    Flash Point: 282.6±32.9 °C
    Index of Refraction: 1.621
    Molar Refractivity: 110.6±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.94
    ACD/LogD (pH 5.5): 0.26
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.71
    ACD/LogD (pH 7.4): 1.98
    ACD/BCF (pH 7.4): 12.87
    ACD/KOC (pH 7.4): 139.72
    Polar Surface Area: 53 Å2
    Polarizability: 43.8±0.5 10-24cm3
    Surface Tension: 45.3±7.0 dyne/cm
    Molar Volume: 314.3±7.0 cm3

    Click to predict properties on the Chemicalize site


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