ChemSpider 2D Image | N-{[4-({4-[(Z)-(2,4-Dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)phenyl]sulfonyl}-D-glutamic acid | C22H20N2O9S2

N-{[4-({4-[(Z)-(2,4-Dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)phenyl]sulfonyl}-D-glutamic acid

  • Molecular FormulaC22H20N2O9S2
  • Average mass520.532 Da
  • Monoisotopic mass520.061035 Da
  • ChemSpider ID26328115
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(2r)-2-[[4-[[4-[(Z)-(2,4-Dioxo-1,3-Thiazolidin-5-Ylidene)methyl]phenoxy]methyl]phenyl]sulfonylamino]pentanedioic Acid
Acide N-{[4-({4-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidène)méthyl]phénoxy}méthyl)phényl]sulfonyl}-D-glutamique [French] [ACD/IUPAC Name]
D-Glutamic acid, N-[[4-[[4-[(Z)-(2,4-dioxo-5-thiazolidinylidene)methyl]phenoxy]methyl]phenyl]sulfonyl]- [ACD/Index Name]
N-{[4-({4-[(Z)-(2,4-Dioxo-1,3-thiazolidin-5-yliden)methyl]phenoxy}methyl)phenyl]sulfonyl}-D-glutaminsäure [German] [ACD/IUPAC Name]
N-{[4-({4-[(Z)-(2,4-Dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)phenyl]sulfonyl}-D-glutamic acid [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.665
Molar Refractivity: 124.8±0.4 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 1.02
ACD/LogD (pH 5.5): -2.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.98
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 210 Å2
Polarizability: 49.5±0.5 10-24cm3
Surface Tension: 75.6±3.0 dyne/cm
Molar Volume: 336.0±3.0 cm3

Click to predict properties on the Chemicalize site