ChemSpider 2D Image | 6-[{[4-(Acetamidomethyl)phenyl]sulfonyl}(1,1-dioxidotetrahydro-3-thiophenyl)amino]hexanoic acid | C19H28N2O7S2

6-[{[4-(Acetamidomethyl)phenyl]sulfonyl}(1,1-dioxidotetrahydro-3-thiophenyl)amino]hexanoic acid

  • Molecular FormulaC19H28N2O7S2
  • Average mass460.565 Da
  • Monoisotopic mass460.133789 Da
  • ChemSpider ID57255186

More details:

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

6-[{[4-(Acetamidomethyl)phenyl]sulfonyl}(1,1-dioxidotetrahydro-3-thiophenyl)amino]hexanoic acid [ACD/IUPAC Name]
6-[{[4-(Acetamidomethyl)phenyl]sulfonyl}(1,1-dioxidotetrahydro-3-thiophenyl)amino]hexansäure [German] [ACD/IUPAC Name]
Acide 6-[{[4-(acétamidométhyl)phényl]sulfonyl}(1,1-dioxydotétrahydro-3-thiophényl)amino]hexanoïque [French] [ACD/IUPAC Name]
Hexanoic acid, 6-[[[4-[(acetylamino)methyl]phenyl]sulfonyl](tetrahydro-1,1-dioxido-3-thienyl)amino]- [ACD/Index Name]
6-[({4-[(acetylamino)methyl]phenyl}sulfonyl)(1,1-dioxidotetrahydro-3-thienyl)amino]hexanoic acid
MFCD29908869

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: 1.598
Molar Refractivity: 111.8±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: -0.42
ACD/LogD (pH 5.5): -0.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.51
ACD/LogD (pH 7.4): -2.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 155 Å2
Polarizability: 44.3±0.5 10-24cm3
Surface Tension: 65.4±5.0 dyne/cm
Molar Volume: 327.9±5.0 cm3

Click to predict properties on the Chemicalize site


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