ChemSpider 2D Image | BLU554 | C24H24Cl2N4O4

BLU554

  • Molecular FormulaC24H24Cl2N4O4
  • Average mass503.378 Da
  • Monoisotopic mass502.117462 Da
  • ChemSpider ID58828666

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1707289-21-1 [RN]
2-Propenamide, N-[(3S,4S)-3-[[6-(2,6-dichloro-3,5-dimethoxyphenyl)-2-quinazolinyl]amino]tetrahydro-2H-pyran-4-yl]- [ACD/Index Name]
BLU554
BLU-554
N-[(3S,4S)-3-{[6-(2,6-Dichlor-3,5-dimethoxyphenyl)-2-chinazolinyl]amino}tetrahydro-2H-pyran-4-yl]acrylamid [German] [ACD/IUPAC Name]
N-[(3S,4S)-3-{[6-(2,6-Dichloro-3,5-dimethoxyphenyl)-2-quinazolinyl]amino}tetrahydro-2H-pyran-4-yl]acrylamide [ACD/IUPAC Name]
N-[(3S,4S)-3-{[6-(2,6-Dichloro-3,5-diméthoxyphényl)-2-quinazolinyl]amino}tétrahydro-2H-pyran-4-yl]acrylamide [French] [ACD/IUPAC Name]
blu-554 (blu554)
Fisogatinib
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL4514636/
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.647
    Molar Refractivity: 130.9±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 1
    ACD/LogP: 3.14
    ACD/LogD (pH 5.5): 3.61
    ACD/BCF (pH 5.5): 287.65
    ACD/KOC (pH 5.5): 1728.55
    ACD/LogD (pH 7.4): 3.83
    ACD/BCF (pH 7.4): 478.92
    ACD/KOC (pH 7.4): 2877.96
    Polar Surface Area: 95 Å2
    Polarizability: 51.9±0.5 10-24cm3
    Surface Tension: 64.6±5.0 dyne/cm
    Molar Volume: 360.3±5.0 cm3

    Click to predict properties on the Chemicalize site


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