ChemSpider 2D Image | S-777469 | C23H27FN2O4

S-777469

  • Molecular FormulaC23H27FN2O4
  • Average mass414.470 Da
  • Monoisotopic mass414.195496 Da
  • ChemSpider ID28531284

More details:

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

1-({[6-Ethyl-1-(4-fluorbenzyl)-5-methyl-2-oxo-1,2-dihydro-3-pyridinyl]carbonyl}amino)cyclohexancarbonsäure [German] [ACD/IUPAC Name]
1-({[6-Ethyl-1-(4-fluorobenzyl)-5-methyl-2-oxo-1,2-dihydro-3-pyridinyl]carbonyl}amino)cyclohexanecarboxylic acid [ACD/IUPAC Name]
885496-53-7 [RN]
88NI79737I
Acide 1-({[6-éthyl-1-(4-fluorobenzyl)-5-méthyl-2-oxo-1,2-dihydro-3-pyridinyl]carbonyl}amino)cyclohexanecarboxylique [French] [ACD/IUPAC Name]
Cyclohexanecarboxylic acid, 1-[[[6-ethyl-1-[(4-fluorophenyl)methyl]-1,2-dihydro-5-methyl-2-oxo-3-pyridinyl]carbonyl]amino]- [ACD/Index Name]
S-777469
1-(6-ethyl-1-(4-fluorobenzyl)-5-methyl-2-oxo-1,2-dihydropyridine-3-carboxamido)cyclohexanecarboxylic acid
UNII:88NI79737I

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 678.2±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 104.6±3.0 kJ/mol
    Flash Point: 363.9±31.5 °C
    Index of Refraction: 1.596
    Molar Refractivity: 110.1±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 3.53
    ACD/LogD (pH 5.5): 0.72
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 7.58
    ACD/LogD (pH 7.4): -0.82
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 87 Å2
    Polarizability: 43.6±0.5 10-24cm3
    Surface Tension: 55.0±5.0 dyne/cm
    Molar Volume: 323.4±5.0 cm3

    Click to predict properties on the Chemicalize site


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