ChemSpider 2D Image | N-(1,3-Dimethyl-6-nitro-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide | C20H19N7O4S

N-(1,3-Dimethyl-6-nitro-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide

  • Molecular FormulaC20H19N7O4S
  • Average mass453.474 Da
  • Monoisotopic mass453.121918 Da
  • ChemSpider ID68528863

More details:

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

Acetamide, N-(2,3-dihydro-1,3-dimethyl-6-nitro-2-oxo-1H-benzimidazol-5-yl)-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)thio]- [ACD/Index Name]
N-(1,3-Dimethyl-6-nitro-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamid [German] [ACD/IUPAC Name]
N-(1,3-Dimethyl-6-nitro-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide [ACD/IUPAC Name]
N-(1,3-Diméthyl-6-nitro-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-2-[(4-méthyl-5-phényl-4H-1,2,4-triazol-3-yl)sulfanyl]acétamide [French] [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: 1.738
Molar Refractivity: 120.2±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.03
ACD/LogD (pH 5.5): 2.51
ACD/BCF (pH 5.5): 47.56
ACD/KOC (pH 5.5): 552.26
ACD/LogD (pH 7.4): 2.51
ACD/BCF (pH 7.4): 47.55
ACD/KOC (pH 7.4): 552.21
Polar Surface Area: 154 Å2
Polarizability: 47.6±0.5 10-24cm3
Surface Tension: 66.6±7.0 dyne/cm
Molar Volume: 298.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement