ChemSpider 2D Image | 3-[5-(Diethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(3,4,5-trimethoxyphenyl)propanamide | C22H29N5O6S

3-[5-(Diethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(3,4,5-trimethoxyphenyl)propanamide

  • Molecular FormulaC22H29N5O6S
  • Average mass491.561 Da
  • Monoisotopic mass491.183868 Da
  • ChemSpider ID29041994

More details:

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

1H-1,2,3-Benzotriazole-1-propanamide, 5-[(diethylamino)sulfonyl]-N-(3,4,5-trimethoxyphenyl)- [ACD/Index Name]
3-[5-(Diethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(3,4,5-trimethoxyphenyl)propanamid [German] [ACD/IUPAC Name]
3-[5-(Diethylsulfamoyl)-1H-benzotriazol-1-yl]-N-(3,4,5-trimethoxyphenyl)propanamide [ACD/IUPAC Name]
3-[5-(Diéthylsulfamoyl)-1H-benzotriazol-1-yl]-N-(3,4,5-triméthoxyphényl)propanamide [French] [ACD/IUPAC Name]
3-{5-[(diethylamino)sulfonyl]-1H-1,2,3-benzotriazol-1-yl}-N-(3,4,5-trimethoxyphenyl)propanamide

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.605
Molar Refractivity: 127.2±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 2.18
ACD/BCF (pH 5.5): 26.59
ACD/KOC (pH 5.5): 364.31
ACD/LogD (pH 7.4): 2.18
ACD/BCF (pH 7.4): 26.59
ACD/KOC (pH 7.4): 364.32
Polar Surface Area: 133 Å2
Polarizability: 50.4±0.5 10-24cm3
Surface Tension: 48.3±7.0 dyne/cm
Molar Volume: 369.2±7.0 cm3

Click to predict properties on the Chemicalize site


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