ChemSpider 2D Image | N,N'-(1,4-Butanediyldi-1,3,4-thiadiazole-5,2-diyl)bis[2-(5-isoquinolinyl)acetamide] | C30H26N8O2S2

N,N'-(1,4-Butanediyldi-1,3,4-thiadiazole-5,2-diyl)bis[2-(5-isoquinolinyl)acetamide]

  • Molecular FormulaC30H26N8O2S2
  • Average mass594.710 Da
  • Monoisotopic mass594.161987 Da
  • ChemSpider ID58926902

More details:

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

5-Isoquinolineacetamide, N,N'-(1,4-butanediyldi-1,3,4-thiadiazole-5,2-diyl)bis- [ACD/Index Name]
N,N'-(1,4-Butandiyldi-1,3,4-thiadiazol-5,2-diyl)bis[2-(5-isochinolinyl)acetamid] [German] [ACD/IUPAC Name]
N,N'-(1,4-Butanediyldi-1,3,4-thiadiazole-5,2-diyl)bis[2-(5-isoquinoléinyl)acétamide] [French] [ACD/IUPAC Name]
N,N'-(1,4-Butanediyldi-1,3,4-thiadiazole-5,2-diyl)bis[2-(5-isoquinolinyl)acetamide] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.756
Molar Refractivity: 168.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 3.22
ACD/LogD (pH 5.5): 3.69
ACD/BCF (pH 5.5): 321.03
ACD/KOC (pH 5.5): 1781.42
ACD/LogD (pH 7.4): 3.94
ACD/BCF (pH 7.4): 571.27
ACD/KOC (pH 7.4): 3170.07
Polar Surface Area: 192 Å2
Polarizability: 66.6±0.5 10-24cm3
Surface Tension: 80.0±3.0 dyne/cm
Molar Volume: 410.1±3.0 cm3

Click to predict properties on the Chemicalize site


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