ChemSpider 2D Image | N-{3-[({4-[(Z)-(2,4-Dioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl}amino)methyl]benzoyl}-D-glutamic acid | C23H21N3O7S

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

  • Molecular FormulaC23H21N3O7S
  • Average mass483.494 Da
  • Monoisotopic mass483.110016 Da
  • ChemSpider ID25060283
  • 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

Acide N-{3-[({4-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidène)méthyl]phényl}amino)méthyl]benzoyl}-D-glutamique [French] [ACD/IUPAC Name]
D-Glutamic acid, N-[3-[[[4-[(Z)-(2,4-dioxo-5-thiazolidinylidene)methyl]phenyl]amino]methyl]benzoyl]- [ACD/Index Name]
N-({3-[({4-[(Z)-(2,4-Dioxo-1,3-Thiazolidin-5-Ylidene)methyl]phenyl}amino)methyl]phenyl}carbonyl)-D-Glutamic Acid
N-{3-[({4-[(Z)-(2,4-Dioxo-1,3-thiazolidin-5-yliden)methyl]phenyl}amino)methyl]benzoyl}-D-glutaminsäure [German] [ACD/IUPAC Name]
N-{3-[({4-[(Z)-(2,4-Dioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl}amino)methyl]benzoyl}-D-glutamic acid [ACD/IUPAC Name]
84759-06-8 [RN]
VSV

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.711
Molar Refractivity: 125.6±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 0.03
ACD/LogD (pH 5.5): -2.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 187 Å2
Polarizability: 49.8±0.5 10-24cm3
Surface Tension: 81.2±3.0 dyne/cm
Molar Volume: 321.2±3.0 cm3

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