ChemSpider 2D Image | 2-Deoxy-2-({[4-hydroxy-1-(2-methoxyphenyl)-6-oxo-1,6-dihydro-3-pyridazinyl]carbonyl}amino)-D-threo-hexopyranose | C18H21N3O9

2-Deoxy-2-({[4-hydroxy-1-(2-methoxyphenyl)-6-oxo-1,6-dihydro-3-pyridazinyl]carbonyl}amino)-D-threo-hexopyranose

  • Molecular FormulaC18H21N3O9
  • Average mass423.374 Da
  • Monoisotopic mass423.127777 Da
  • ChemSpider ID34744171

  • defined stereocentres - 2 of 5 defined stereocentres

More details:

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

2-Deoxy-2-({[4-hydroxy-1-(2-methoxyphenyl)-6-oxo-1,6-dihydro-3-pyridazinyl]carbonyl}amino)-D-threo-hexopyranose [ACD/IUPAC Name]
2-Desoxy-2-({[4-hydroxy-1-(2-methoxyphenyl)-6-oxo-1,6-dihydro-3-pyridazinyl]carbonyl}amino)-D-threo-hexopyranose [German] [ACD/IUPAC Name]
2-Désoxy-2-({[4-hydroxy-1-(2-méthoxyphényl)-6-oxo-1,6-dihydro-3-pyridazinyl]carbonyl}amino)-D-thréo-hexopyranose [French] [ACD/IUPAC Name]
D-threo-Hexopyranose, 2-deoxy-2-[[[1,6-dihydro-4-hydroxy-1-(2-methoxyphenyl)-6-oxo-3-pyridazinyl]carbonyl]amino]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.699
Molar Refractivity: 96.5±0.5 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -1.57
ACD/LogD (pH 5.5): -3.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 181 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 72.4±7.0 dyne/cm
Molar Volume: 249.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement