ChemSpider 2D Image | 6-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonyl}-1,3-dimethyl-7-propyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione | C22H26ClN5O3

6-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonyl}-1,3-dimethyl-7-propyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione

  • Molecular FormulaC22H26ClN5O3
  • Average mass443.927 Da
  • Monoisotopic mass443.172424 Da
  • ChemSpider ID21931153

More details:

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

1H-Pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione, 6-[[4-(3-chlorophenyl)-1-piperazinyl]carbonyl]-1,3-dimethyl-7-propyl- [ACD/Index Name]
6-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonyl}-1,3-dimethyl-7-propyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione [ACD/IUPAC Name]
6-{[4-(3-Chlorophényl)-1-pipérazinyl]carbonyl}-1,3-diméthyl-7-propyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione [French] [ACD/IUPAC Name]
6-{[4-(3-Chlorphenyl)-1-piperazinyl]carbonyl}-1,3-dimethyl-7-propyl-1H-pyrrolo[2,3-d]pyrimidin-2,4(3H,7H)-dion [German] [ACD/IUPAC Name]
1021059-47-1 [RN]
6-(4-(3-chlorophenyl)piperazine-1-carbonyl)-1,3-dimethyl-7-propyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
6-[4-(3-Chloro-phenyl)-piperazine-1-carbonyl]-1,3-dimethyl-7-propyl-1,7-dihydro-pyrrolo[2,3-d]pyrimidine-2,4-dione
6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1,3-dimethyl-7-propyl-1H,2H,3H,4H,7H-pyrrolo[2,3-d]pyrimidine-2,4-dione
6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-1,3-dimethyl-7-propylpyrrolo[2,3-d]pyrimidine-2,4-dione
6-{[4-(3-chlorophenyl)piperazin-1-yl]carbonyl}-1,3-dimethyl-7-propyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
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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: 657.5±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 96.8±3.0 kJ/mol
    Flash Point: 351.4±34.3 °C
    Index of Refraction: 1.661
    Molar Refractivity: 120.1±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.47
    ACD/LogD (pH 5.5): 2.66
    ACD/BCF (pH 5.5): 61.87
    ACD/KOC (pH 5.5): 666.66
    ACD/LogD (pH 7.4): 2.66
    ACD/BCF (pH 7.4): 61.89
    ACD/KOC (pH 7.4): 666.88
    Polar Surface Area: 69 Å2
    Polarizability: 47.6±0.5 10-24cm3
    Surface Tension: 53.4±7.0 dyne/cm
    Molar Volume: 324.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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