ChemSpider 2D Image | 3-Methylbutyl N-[4-(carbamoylsulfamoyl)phenyl]-N-(4-{2-[(tetrahydro-2-furanylmethyl)amino]-1,3-thiazol-4-yl}phenyl)glycinate | C28H35N5O6S2

3-Methylbutyl N-[4-(carbamoylsulfamoyl)phenyl]-N-(4-{2-[(tetrahydro-2-furanylmethyl)amino]-1,3-thiazol-4-yl}phenyl)glycinate

  • Molecular FormulaC28H35N5O6S2
  • Average mass601.737 Da
  • Monoisotopic mass601.202881 Da
  • ChemSpider ID102782688

More details:

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

3-Methylbutyl N-[4-(carbamoylsulfamoyl)phenyl]-N-(4-{2-[(tetrahydro-2-furanylmethyl)amino]-1,3-thiazol-4-yl}phenyl)glycinate [ACD/IUPAC Name]
3-Methylbutyl-N-[4-(carbamoylsulfamoyl)phenyl]-N-(4-{2-[(tetrahydro-2-furanylmethyl)amino]-1,3-thiazol-4-yl}phenyl)glycinat [German] [ACD/IUPAC Name]
Glycine, N-[4-[[(aminocarbonyl)amino]sulfonyl]phenyl]-N-[4-[2-[[(tetrahydro-2-furanyl)methyl]amino]-4-thiazolyl]phenyl]-, 3-methylbutyl ester [ACD/Index Name]
N-[4-(Carbamoylsulfamoyl)phényl]-N-(4-{2-[(tétrahydro-2-furanylméthyl)amino]-1,3-thiazol-4-yl}phényl)glycinate de 3-méthylbutyle [French] [ACD/IUPAC Name]

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: 1.615
Molar Refractivity: 157.6±0.4 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 4.01
ACD/LogD (pH 5.5): 2.90
ACD/BCF (pH 5.5): 53.16
ACD/KOC (pH 5.5): 305.14
ACD/LogD (pH 7.4): 1.97
ACD/BCF (pH 7.4): 6.34
ACD/KOC (pH 7.4): 36.39
Polar Surface Area: 190 Å2
Polarizability: 62.5±0.5 10-24cm3
Surface Tension: 60.1±3.0 dyne/cm
Molar Volume: 451.5±3.0 cm3

Click to predict properties on the Chemicalize site


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