ChemSpider 2D Image | N-({5-Butoxy-4'-[(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-2-biphenylyl}sulfonyl)hexanamide | C33H42N4O4S

N-({5-Butoxy-4'-[(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-2-biphenylyl}sulfonyl)hexanamide

  • Molecular FormulaC33H42N4O4S
  • Average mass590.776 Da
  • Monoisotopic mass590.292664 Da
  • ChemSpider ID8135778

More details:

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

Hexanamide, N-[[5-butoxy-4'-[(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl][1,1'-biphenyl]-2-yl]sulfonyl]- [ACD/Index Name]
N-({5-Butoxy-4'-[(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-2-biphenylyl}sulfonyl)hexanamid [German] [ACD/IUPAC Name]
N-({5-Butoxy-4'-[(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-2-biphenylyl}sulfonyl)hexanamide [ACD/IUPAC Name]
N-({5-Butoxy-4'-[(2-éthyl-5,7-diméthyl-3H-imidazo[4,5-b]pyridin-3-yl)méthyl]-2-biphénylyl}sulfonyl)hexanamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.599
Molar Refractivity: 168.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 7.33
ACD/LogD (pH 5.5): 5.49
ACD/BCF (pH 5.5): 3909.37
ACD/KOC (pH 5.5): 5040.60
ACD/LogD (pH 7.4): 5.05
ACD/BCF (pH 7.4): 1440.51
ACD/KOC (pH 7.4): 1857.35
Polar Surface Area: 112 Å2
Polarizability: 66.8±0.5 10-24cm3
Surface Tension: 44.0±7.0 dyne/cm
Molar Volume: 493.4±7.0 cm3

Click to predict properties on the Chemicalize site


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