ChemSpider 2D Image | Ethyl (2-{[N-(2-thienylsulfonyl)-beta-alanyl]amino}-1,3-thiazol-4-yl)acetate | C14H17N3O5S3

Ethyl (2-{[N-(2-thienylsulfonyl)-β-alanyl]amino}-1,3-thiazol-4-yl)acetate

  • Molecular FormulaC14H17N3O5S3
  • Average mass403.497 Da
  • Monoisotopic mass403.033020 Da
  • ChemSpider ID30598704

More details:

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

(2-{[N-(2-Thiénylsulfonyl)-β-alanyl]amino}-1,3-thiazol-4-yl)acétate d'éthyle [French] [ACD/IUPAC Name]
4-Thiazoleacetic acid, 2-[[1-oxo-3-[(2-thienylsulfonyl)amino]propyl]amino]-, ethyl ester [ACD/Index Name]
Ethyl (2-{[N-(2-thienylsulfonyl)-β-alanyl]amino}-1,3-thiazol-4-yl)acetate [ACD/IUPAC Name]
Ethyl-(2-{[N-(2-thienylsulfonyl)-β-alanyl]amino}-1,3-thiazol-4-yl)acetat [German] [ACD/IUPAC Name]

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: 1.614
Molar Refractivity: 96.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 1.70
ACD/LogD (pH 5.5): 1.55
ACD/BCF (pH 5.5): 8.94
ACD/KOC (pH 5.5): 166.98
ACD/LogD (pH 7.4): 1.54
ACD/BCF (pH 7.4): 8.68
ACD/KOC (pH 7.4): 161.96
Polar Surface Area: 179 Å2
Polarizability: 38.1±0.5 10-24cm3
Surface Tension: 67.0±3.0 dyne/cm
Molar Volume: 275.5±3.0 cm3

Click to predict properties on the Chemicalize site


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