ChemSpider 2D Image | 5-Methoxy-2-nitro-N-(6-oxo-6-{[2-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)ethyl]amino}hexyl)benzamide | C19H23N7O5S

5-Methoxy-2-nitro-N-(6-oxo-6-{[2-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)ethyl]amino}hexyl)benzamide

  • Molecular FormulaC19H23N7O5S
  • Average mass461.495 Da
  • Monoisotopic mass461.148132 Da
  • ChemSpider ID66799304

More details:

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

5-Methoxy-2-nitro-N-(6-oxo-6-{[2-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)ethyl]amino}hexyl)benzamid [German] [ACD/IUPAC Name]
5-Methoxy-2-nitro-N-(6-oxo-6-{[2-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)ethyl]amino}hexyl)benzamide [ACD/IUPAC Name]
5-Méthoxy-2-nitro-N-(6-oxo-6-{[2-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)éthyl]amino}hexyl)benzamide [French] [ACD/IUPAC Name]
Benzamide, 5-methoxy-2-nitro-N-[6-oxo-6-[[2-(1,2,4-triazolo[3,4-b][1,3,4]thiadiazol-6-yl)ethyl]amino]hexyl]- [ACD/Index 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: 1.695
Molar Refractivity: 118.1±0.5 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 1.09
ACD/LogD (pH 5.5): 1.43
ACD/BCF (pH 5.5): 7.16
ACD/KOC (pH 5.5): 142.39
ACD/LogD (pH 7.4): 1.43
ACD/BCF (pH 7.4): 7.16
ACD/KOC (pH 7.4): 142.39
Polar Surface Area: 185 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 65.8±7.0 dyne/cm
Molar Volume: 307.0±7.0 cm3

Click to predict properties on the Chemicalize site


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