ChemSpider 2D Image | 5-(2,4-Dichlorophenyl)-10-(2,3-dihydroxyphenyl)-1,3,7,7-tetramethyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione | C25H23Cl2N3O5

5-(2,4-Dichlorophenyl)-10-(2,3-dihydroxyphenyl)-1,3,7,7-tetramethyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione

  • Molecular FormulaC25H23Cl2N3O5
  • Average mass516.373 Da
  • Monoisotopic mass515.101501 Da
  • ChemSpider ID21632407

More details:

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

2H-Pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione, 5-(2,4-dichlorophenyl)-10-(2,3-dihydroxyphenyl)-1,7,8,10-tetrahydro-1,3,7,7-tetramethyl- [ACD/Index Name]
5-(2,4-Dichlorophenyl)-10-(2,3-dihydroxyphenyl)-1,3,7,7-tetramethyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione [ACD/IUPAC Name]
5-(2,4-Dichlorophényl)-10-(2,3-dihydroxyphényl)-1,3,7,7-tétraméthyl-1,7,8,10-tétrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione [French] [ACD/IUPAC Name]
5-(2,4-Dichlorphenyl)-10-(2,3-dihydroxyphenyl)-1,3,7,7-tetramethyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazin-2,4(3H)-dion [German] [ACD/IUPAC Name]
5-(2,4-dichlorophenyl)-10-(2,3-dihydroxyphenyl)-1,3,7,7-tetramethyl-8,10-dihydropyrimido[1,2]pyrrolo[4,5-b][1,4]oxazine-2,4-dione
929968-12-7 [RN]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 631.8±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 96.8±3.0 kJ/mol
    Flash Point: 335.9±34.3 °C
    Index of Refraction: 1.694
    Molar Refractivity: 130.7±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 2
    ACD/LogP: 5.36
    ACD/LogD (pH 5.5): 5.01
    ACD/BCF (pH 5.5): 3805.23
    ACD/KOC (pH 5.5): 12717.44
    ACD/LogD (pH 7.4): 5.01
    ACD/BCF (pH 7.4): 3731.91
    ACD/KOC (pH 7.4): 12472.39
    Polar Surface Area: 95 Å2
    Polarizability: 51.8±0.5 10-24cm3
    Surface Tension: 56.2±7.0 dyne/cm
    Molar Volume: 340.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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