ChemSpider 2D Image | 1-(2-{[(3,4-Dimethoxyphenyl)carbamoyl]amino}ethyl)-N,N-diethyl-1H-benzotriazole-5-sulfonamide | C21H28N6O5S

1-(2-{[(3,4-Dimethoxyphenyl)carbamoyl]amino}ethyl)-N,N-diethyl-1H-benzotriazole-5-sulfonamide

  • Molecular FormulaC21H28N6O5S
  • Average mass476.549 Da
  • Monoisotopic mass476.184174 Da
  • ChemSpider ID29065249

More details:

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

1-(2-{[(3,4-Dimethoxyphenyl)carbamoyl]amino}ethyl)-N,N-diethyl-1H-benzotriazol-5-sulfonamid [German] [ACD/IUPAC Name]
1-(2-{[(3,4-Dimethoxyphenyl)carbamoyl]amino}ethyl)-N,N-diethyl-1H-benzotriazole-5-sulfonamide [ACD/IUPAC Name]
1-(2-{[(3,4-Diméthoxyphényl)carbamoyl]amino}éthyl)-N,N-diéthyl-1H-benzotriazole-5-sulfonamide [French] [ACD/IUPAC Name]
1H-1,2,3-Benzotriazole-5-sulfonamide, 1-[2-[[[(3,4-dimethoxyphenyl)amino]carbonyl]amino]ethyl]-N,N-diethyl- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.624
Molar Refractivity: 124.5±0.5 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 2.41
ACD/LogD (pH 5.5): 2.06
ACD/BCF (pH 5.5): 21.55
ACD/KOC (pH 5.5): 313.35
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 21.54
ACD/KOC (pH 7.4): 313.33
Polar Surface Area: 136 Å2
Polarizability: 49.3±0.5 10-24cm3
Surface Tension: 51.4±7.0 dyne/cm
Molar Volume: 352.3±7.0 cm3

Click to predict properties on the Chemicalize site


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