Found 10 results

Search term: MF = 'C_{18}H_{16}N_{8}S_{2}'
ChemSpider 2D Image | 3,5-Bis[(1H-benzimidazol-2-ylsulfanyl)methyl]-4H-1,2,4-triazol-4-amine | C18H16N8S2

3,5-Bis[(1H-benzimidazol-2-ylsulfanyl)methyl]-4H-1,2,4-triazol-4-amine

  • Molecular FormulaC18H16N8S2
  • Average mass408.503 Da
  • Monoisotopic mass408.093933 Da
  • ChemSpider ID62520967

More details:

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

3,5-Bis[(1H-benzimidazol-2-ylsulfanyl)methyl]-4H-1,2,4-triazol-4-amin [German] [ACD/IUPAC Name]
3,5-Bis[(1H-benzimidazol-2-ylsulfanyl)methyl]-4H-1,2,4-triazol-4-amine [ACD/IUPAC Name]
3,5-Bis[(1H-benzimidazol-2-ylsulfanyl)méthyl]-4H-1,2,4-triazol-4-amine [French] [ACD/IUPAC Name]
4H-1,2,4-Triazol-4-amine, 3,5-bis[(1H-benzimidazol-2-ylthio)methyl]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 783.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.0±3.0 kJ/mol
Flash Point: 427.5±35.7 °C
Index of Refraction: 1.887
Molar Refractivity: 112.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.93
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 53.22
ACD/KOC (pH 5.5): 564.23
ACD/LogD (pH 7.4): 2.69
ACD/BCF (pH 7.4): 65.12
ACD/KOC (pH 7.4): 690.40
Polar Surface Area: 165 Å2
Polarizability: 44.6±0.5 10-24cm3
Surface Tension: 81.3±7.0 dyne/cm
Molar Volume: 244.5±7.0 cm3

Click to predict properties on the Chemicalize site


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