ChemSpider 2D Image | 9-METHOXY-1,3-DIMETHYL-12-THIOXOPYRIDO(1',2':3,4)IMIDAZO(1,2-A)BENZIMIDAZOL-2(12H)-ONE | C16H13N3O2S

9-METHOXY-1,3-DIMETHYL-12-THIOXOPYRIDO(1',2':3,4)IMIDAZO(1,2-A)BENZIMIDAZOL-2(12H)-ONE

  • Molecular FormulaC16H13N3O2S
  • Average mass311.358 Da
  • Monoisotopic mass311.072845 Da
  • ChemSpider ID21896793

More details:

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

125656-83-9 [RN]
9-METHOXY-1,3-DIMETHYL-12-THIOXOPYRIDO(1',2':3,4)IMIDAZO(1,2-A)BENZIMIDAZOL-2(12H)-ONE
9-Methoxy-1,3-dimethyl-12-thioxopyrido[1',2':3,4]imidazo[1,2-a]benzimidazol-2(12H)-on [German] [ACD/IUPAC Name]
9-Methoxy-1,3-dimethyl-12-thioxopyrido[1',2':3,4]imidazo[1,2-a]benzimidazol-2(12H)-one [ACD/IUPAC Name]
9-Méthoxy-1,3-diméthyl-12-thioxopyrido[1',2':3,4]imidazo[1,2-a]benzimidazol-2(12H)-one [French] [ACD/IUPAC Name]
Pyrido[1',2':3,4]imidazo[1,2-a]benzimidazol-2(12H)-one, 9-methoxy-1,3-dimethyl-12-thioxo- [ACD/Index Name]
[125656-83-9] [RN]
1,3-DIMETHYL-9-METHOXY-12-THIOXOPYRIDO[1',2':3,4]IMIDAZO[1,2-A]BENZIMIDAZOL-2(12H)-ONE
8(9)-Methoxy-1,3-dimethyl-12-thioxopyrido[1',2':3,4]imidazo[1,2-a]benzimidazol-2-(12H)-one
9-Methoxy-1,3-dimethyl-12-thioxobenzo[4',5']imidazo[2',1':2,3]imidazo[1,5-a]pyridin-2(12H)-one
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

02U2W351IL [DBID]
UNII:02U2W351IL [DBID]
UNII-02U2W351IL [DBID]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 469.1±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 73.1±3.0 kJ/mol
    Flash Point: 237.5±31.5 °C
    Index of Refraction: 1.745
    Molar Refractivity: 86.1±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 3.80
    ACD/LogD (pH 5.5): 3.42
    ACD/BCF (pH 5.5): 236.05
    ACD/KOC (pH 5.5): 1738.59
    ACD/LogD (pH 7.4): 3.42
    ACD/BCF (pH 7.4): 236.07
    ACD/KOC (pH 7.4): 1738.73
    Polar Surface Area: 79 Å2
    Polarizability: 34.1±0.5 10-24cm3
    Surface Tension: 52.7±7.0 dyne/cm
    Molar Volume: 212.3±7.0 cm3

    Click to predict properties on the Chemicalize site


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