ChemSpider 2D Image | 4-(2-Fluorobenzyl)-N-[3-(4-morpholinyl)propyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide | C21H24FN3O2S

4-(2-Fluorobenzyl)-N-[3-(4-morpholinyl)propyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide

  • Molecular FormulaC21H24FN3O2S
  • Average mass401.498 Da
  • Monoisotopic mass401.157318 Da
  • ChemSpider ID26040325

More details:

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

4-(2-Fluorbenzyl)-N-[3-(4-morpholinyl)propyl]-4H-thieno[3,2-b]pyrrol-5-carboxamid [German] [ACD/IUPAC Name]
4-(2-Fluorobenzyl)-N-[3-(4-morpholinyl)propyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide [ACD/IUPAC Name]
4-(2-Fluorobenzyl)-N-[3-(4-morpholinyl)propyl]-4H-thiéno[3,2-b]pyrrole-5-carboxamide [French] [ACD/IUPAC Name]
4H-Thieno[3,2-b]pyrrole-5-carboxamide, 4-[(2-fluorophenyl)methyl]-N-[3-(4-morpholinyl)propyl]- [ACD/Index Name]
1224167-56-9 [RN]
4-(2-Fluoro-benzyl)-4H-thieno[3,2-b]pyrrole-5-carboxylic acid (3-morpholin-4-yl-propyl)-amide
4-(2-fluorobenzyl)-N-[3-(morpholin-4-yl)propyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide
4-[(2-fluorophenyl)methyl]-N-(3-morpholin-4-ylpropyl)thieno[3,2-b]pyrrole-5-carboxamide

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 646.8±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 95.4±3.0 kJ/mol
    Flash Point: 345.0±31.5 °C
    Index of Refraction: 1.644
    Molar Refractivity: 110.0±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 3.48
    ACD/LogD (pH 5.5): 1.63
    ACD/BCF (pH 5.5): 4.01
    ACD/KOC (pH 5.5): 31.33
    ACD/LogD (pH 7.4): 3.10
    ACD/BCF (pH 7.4): 118.67
    ACD/KOC (pH 7.4): 928.17
    Polar Surface Area: 75 Å2
    Polarizability: 43.6±0.5 10-24cm3
    Surface Tension: 50.1±7.0 dyne/cm
    Molar Volume: 303.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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