ChemSpider 2D Image | 2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-2-[1,2,3,4-tetrahydroxy-1-(hydroxymethyl)-5-phosphonooxy-pentyl]thiazol-3-ium-5-yl]ethyl phosphono hydrogen phosphate | C18H32N4O16P3S

2-[3-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-2-[1,2,3,4-tetrahydroxy-1-(hydroxymethyl)-5-phosphonooxy-pentyl]thiazol-3-ium-5-yl]ethyl phosphono hydrogen phosphate

  • Molecular FormulaC18H32N4O16P3S
  • Average mass685.450 Da
  • Monoisotopic mass685.074158 Da
  • ChemSpider ID22378297

  • Charge - Charge

More details:

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

Density:
Boiling Point:
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Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 20
#H bond donors: 12
#Freely Rotating Bonds: 16
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 395 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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