ChemSpider 2D Image | 2-[(5-Nitro-1,3-thiazol-2-yl)carbamoyl]phenyl D-glucopyranosiduronic acid | C16H15N3O10S

2-[(5-Nitro-1,3-thiazol-2-yl)carbamoyl]phenyl D-glucopyranosiduronic acid

  • Molecular FormulaC16H15N3O10S
  • Average mass441.369 Da
  • Monoisotopic mass441.047821 Da
  • ChemSpider ID35031766

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

2-[(5-Nitro-1,3-thiazol-2-yl)carbamoyl]phenyl D-glucopyranosiduronic acid [ACD/IUPAC Name]
2-[(5-Nitro-1,3-thiazol-2-yl)carbamoyl]phenyl-D-glucopyranosiduronsäure [German] [ACD/IUPAC Name]
Acide D-glucopyranosiduronique de 2-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phényle [French] [ACD/IUPAC Name]
Benzamide, 2-(D-glucopyranuronosyloxy)-N-(5-nitro-2-thiazolyl)- [ACD/Index Name]
(2S,3S,4S,5R)-3,4,5-trihydroxy-6-{2-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenoxy}oxane-2-carboxylic acid
Tizoxanide Glucuronide

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

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.752
Molar Refractivity: 99.4±0.3 cm3
#H bond acceptors: 13
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -0.60
ACD/LogD (pH 5.5): -3.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 233 Å2
Polarizability: 39.4±0.5 10-24cm3
Surface Tension: 117.1±3.0 dyne/cm
Molar Volume: 243.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement