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Search term: HHYNSLYWCJJEHR-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-{[2-Butyl-4-(methylsulfanyl)-1-({2'-[(propylcarbamoyl)sulfamoyl]-4-biphenylyl}methyl)-1H-imidazol-5-yl]carbonyl}isoleucine | C32H43N5O6S2

N-{[2-Butyl-4-(methylsulfanyl)-1-({2'-[(propylcarbamoyl)sulfamoyl]-4-biphenylyl}methyl)-1H-imidazol-5-yl]carbonyl}isoleucine

  • Molecular FormulaC32H43N5O6S2
  • Average mass657.844 Da
  • Monoisotopic mass657.265503 Da
  • ChemSpider ID23168489

More details:

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

Isoleucine, N-[[2-butyl-4-(methylthio)-1-[[2'-[[[(propylamino)carbonyl]amino]sulfonyl][1,1'-biphenyl]-4-yl]methyl]-1H-imidazol-5-yl]carbonyl]- [ACD/Index Name]
N-{[2-Butyl-4-(methylsulfanyl)-1-({2'-[(propylcarbamoyl)sulfamoyl]-4-biphenylyl}methyl)-1H-imidazol-5-yl]carbonyl}isoleucin [German] [ACD/IUPAC Name]
N-{[2-Butyl-4-(methylsulfanyl)-1-({2'-[(propylcarbamoyl)sulfamoyl]-4-biphenylyl}methyl)-1H-imidazol-5-yl]carbonyl}isoleucine [ACD/IUPAC Name]
N-{[2-Butyl-4-(méthylsulfanyl)-1-({2'-[(propylcarbamoyl)sulfamoyl]-4-biphénylyl}méthyl)-1H-imidazol-5-yl]carbonyl}isoleucine [French] [ACD/IUPAC Name]
N-{[2-butyl-4-(methylsulfanyl)-1-({2'-[(propylcarbamoyl)sulfamoyl]biphenyl-4-yl}methyl)-1H-imidazol-5-yl]carbonyl}isoleucine
N-[[2-butyl-4-(methylthio)-1-[[2'-[[[(propylamino)carbonylamino]sulfonyl](1,1'-biphenyl)-4-yl]carbonyl]isoleucine

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: 1.617
Molar Refractivity: 178.6±0.5 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: 5.60
ACD/LogD (pH 5.5): 1.54
ACD/BCF (pH 5.5): 1.63
ACD/KOC (pH 5.5): 6.78
ACD/LogD (pH 7.4): -0.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 193 Å2
Polarizability: 70.8±0.5 10-24cm3
Surface Tension: 49.6±7.0 dyne/cm
Molar Volume: 510.2±7.0 cm3

Click to predict properties on the Chemicalize site


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