ChemSpider 2D Image | PROPOXYPHENYL THIOHYDROXYHOMOSILDENAFIL | C24H34N6O4S2

PROPOXYPHENYL THIOHYDROXYHOMOSILDENAFIL

  • Molecular FormulaC24H34N6O4S2
  • Average mass534.695 Da
  • Monoisotopic mass534.208313 Da
  • ChemSpider ID8405891

More details:

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

479073-90-0 [RN]
5-(5-{[4-(2-Hydroxyethyl)-1-piperazinyl]sulfonyl}-2-propoxyphenyl)-1-methyl-3-propyl-1,4-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-thion [German] [ACD/IUPAC Name]
5-(5-{[4-(2-Hydroxyethyl)-1-piperazinyl]sulfonyl}-2-propoxyphenyl)-1-methyl-3-propyl-1,4-dihydro-7H-pyrazolo[4,3-d]pyrimidine-7-thione [ACD/IUPAC Name]
5-(5-{[4-(2-Hydroxyéthyl)-1-pipérazinyl]sulfonyl}-2-propoxyphényl)-1-méthyl-3-propyl-1,4-dihydro-7H-pyrazolo[4,3-d]pyrimidine-7-thione [French] [ACD/IUPAC Name]
7H-Pyrazolo[4,3-d]pyrimidine-7-thione, 1,4-dihydro-5-[5-[[4-(2-hydroxyethyl)-1-piperazinyl]sulfonyl]-2-propoxyphenyl]-1-methyl-3-propyl- [ACD/Index Name]
PROPOXYPHENYL THIOHYDROXYHOMOSILDENAFIL
5-[5-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonyl-2-propoxyphenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidine-7-thione
PROPOXYPHENYL-THIOHYDROXYHOMOSILDENAFIL
Sildenafil Analogue I (Propoxyphenyl-ThiohydroxyhoMosildenafil)

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

295414T63R [DBID]
UNII:295414T63R [DBID]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 739.2±70.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.6 mmHg at 25°C
    Enthalpy of Vaporization: 113.2±3.0 kJ/mol
    Flash Point: 400.9±35.7 °C
    Index of Refraction: 1.673
    Molar Refractivity: 142.8±0.5 cm3
    #H bond acceptors: 10
    #H bond donors: 2
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 2
    ACD/LogP: 3.13
    ACD/LogD (pH 5.5): 1.51
    ACD/BCF (pH 5.5): 4.12
    ACD/KOC (pH 5.5): 42.33
    ACD/LogD (pH 7.4): 2.67
    ACD/BCF (pH 7.4): 60.35
    ACD/KOC (pH 7.4): 619.84
    Polar Surface Area: 153 Å2
    Polarizability: 56.6±0.5 10-24cm3
    Surface Tension: 54.6±7.0 dyne/cm
    Molar Volume: 381.0±7.0 cm3

    Click to predict properties on the Chemicalize site


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