ChemSpider 2D Image | Methyl 2-[(E)-2-(dimethylamino)vinyl]-6-(4-methoxybenzyl)-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate | C22H23N3O4

Methyl 2-[(E)-2-(dimethylamino)vinyl]-6-(4-methoxybenzyl)-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate

  • Molecular FormulaC22H23N3O4
  • Average mass393.436 Da
  • Monoisotopic mass393.168854 Da
  • ChemSpider ID28611811

  • Double-bond stereo - Double-bond stereo

More details:

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

1,6-Naphthyridine-3-carboxylic acid, 2-[(E)-2-(dimethylamino)ethenyl]-5,6-dihydro-6-[(4-methoxyphenyl)methyl]-5-oxo-, methyl ester [ACD/Index Name]
2-[(E)-2-(Diméthylamino)vinyl]-6-(4-méthoxybenzyl)-5-oxo-5,6-dihydro-1,6-naphtyridine-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 2-[(E)-2-(dimethylamino)vinyl]-6-(4-methoxybenzyl)-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate [ACD/IUPAC Name]
Methyl-2-[(E)-2-(dimethylamino)vinyl]-6-(4-methoxybenzyl)-5-oxo-5,6-dihydro-1,6-naphthyridin-3-carboxylat [German] [ACD/IUPAC Name]
1374510-89-0 [RN]
methyl 2-[(E)-2-(dimethylamino)ethenyl]-6-[(4-methoxyphenyl)methyl]-5-oxo-1,6-naphthyridine-3-carboxylate
MFCD22374883 [MDL number]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 625.7±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 92.6±3.0 kJ/mol
    Flash Point: 332.2±31.5 °C
    Index of Refraction: 1.627
    Molar Refractivity: 111.7±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 3.09
    ACD/LogD (pH 5.5): 1.99
    ACD/BCF (pH 5.5): 12.13
    ACD/KOC (pH 5.5): 120.26
    ACD/LogD (pH 7.4): 2.79
    ACD/BCF (pH 7.4): 76.84
    ACD/KOC (pH 7.4): 762.19
    Polar Surface Area: 72 Å2
    Polarizability: 44.3±0.5 10-24cm3
    Surface Tension: 54.3±3.0 dyne/cm
    Molar Volume: 315.3±3.0 cm3

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