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Search term: FATONWNMDXFMAN-HGTKMLMNSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (2R,4S)-5,5-Dimethyl-2-[(1R)-2-oxo-1-{[(2R)-2-{[(2-oxo-1-imidazolidinyl)carbonyl]amino}-2-phenylacetyl]amino}ethyl]-1,3-thiazolidine-4-carboxylic acid | C20H25N5O6S

(2R,4S)-5,5-Dimethyl-2-[(1R)-2-oxo-1-{[(2R)-2-{[(2-oxo-1-imidazolidinyl)carbonyl]amino}-2-phenylacetyl]amino}ethyl]-1,3-thiazolidine-4-carboxylic acid

  • Molecular FormulaC20H25N5O6S
  • Average mass463.507 Da
  • Monoisotopic mass463.152557 Da
  • ChemSpider ID59053486

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2R,4S)-5,5-Dimethyl-2-[(1R)-2-oxo-1-{[(2R)-2-{[(2-oxo-1-imidazolidinyl)carbonyl]amino}-2-phenylacetyl]amino}ethyl]-1,3-thiazolidin-4-carbonsäure [German] [ACD/IUPAC Name]
(2R,4S)-5,5-Dimethyl-2-[(1R)-2-oxo-1-{[(2R)-2-{[(2-oxo-1-imidazolidinyl)carbonyl]amino}-2-phenylacetyl]amino}ethyl]-1,3-thiazolidine-4-carboxylic acid [ACD/IUPAC Name]
4-Thiazolidinecarboxylic acid, 5,5-dimethyl-2-[(1R)-2-oxo-1-[[(2R)-2-[[(2-oxo-1-imidazolidinyl)carbonyl]amino]-2-phenylacetyl]amino]ethyl]-, (2R,4S)- [ACD/Index Name]
Acide (2R,4S)-5,5-diméthyl-2-[(1R)-2-oxo-1-{[(2R)-2-{[(2-oxo-1-imidazolidinyl)carbonyl]amino}-2-phénylacétyl]amino}éthyl]-1,3-thiazolidine-4-carboxylique [French] [ACD/IUPAC Name]

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: 1.599
Molar Refractivity: 114.6±0.3 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 0.47
ACD/LogD (pH 5.5): -2.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 182 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 59.6±3.0 dyne/cm
Molar Volume: 335.5±3.0 cm3

Click to predict properties on the Chemicalize site


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