ChemSpider 2D Image | lanifibranor | C19H15ClN2O4S2

lanifibranor

  • Molecular FormulaC19H15ClN2O4S2
  • Average mass434.916 Da
  • Monoisotopic mass434.016174 Da
  • ChemSpider ID58828074

More details:

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

1H-Indole-2-butanoic acid, 1-(6-benzothiazolylsulfonyl)-5-chloro- [ACD/Index Name]
28Q8AG0PYL
4-[1-(1,3-Benzothiazol-6-ylsulfonyl)-5-chlor-1H-indol-2-yl]butansäure [German] [ACD/IUPAC Name]
4-[1-(1,3-Benzothiazol-6-ylsulfonyl)-5-chloro-1H-indol-2-yl]butanoic acid [ACD/IUPAC Name]
4-[1-(1,3-benzothiazole-6-sulfonyl)-5-chloro-1H-indol-2-yl]butanoic acid
4-[1-(1,3-benzothiazole-6-sulfonyl)-5-chloroindol-2-yl]butanoic acid
927961-18-0 [RN]
Acide 4-[1-(1,3-benzothiazol-6-ylsulfonyl)-5-chloro-1H-indol-2-yl]butanoïque [French] [ACD/IUPAC Name]
IVA-337
lanifibranor [INN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

10474 [DBID]

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 690.9±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 106.3±3.0 kJ/mol
    Flash Point: 371.6±34.3 °C
    Index of Refraction: 1.727
    Molar Refractivity: 110.8±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 4.30
    ACD/LogD (pH 5.5): 2.82
    ACD/BCF (pH 5.5): 50.18
    ACD/KOC (pH 5.5): 323.79
    ACD/LogD (pH 7.4): 1.01
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 5.12
    Polar Surface Area: 126 Å2
    Polarizability: 43.9±0.5 10-24cm3
    Surface Tension: 65.9±7.0 dyne/cm
    Molar Volume: 278.4±7.0 cm3

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