ChemSpider 2D Image | [[[5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]-[3,4-dihydroxy-5-(6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl] hydrogen phosphate | C21H26N6O15P2

[[[5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]-[3,4-dihydroxy-5-(6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl] hydrogen phosphate

  • Molecular FormulaC21H26N6O15P2
  • Average mass664.410 Da
  • Monoisotopic mass664.093140 Da
  • ChemSpider ID28575132

More details:

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

[[5-(3-CARBAMOYLPYRIDIN-1-IUM-1-YL)-3,4-DIHYDROXY-TETRAHYDROFURAN-2-YL]METHOXY-HYDROXY-PHOSPHORYL][3,4-DIHYDROXY-5-(6-OXO-3H-PURIN-9-YL)TETRAHYDROFURAN-2-YL]METHYL HYDROGEN PHOSPHATE
1897-47-8 [RN]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 21
#H bond donors: 10
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: -5.01
ACD/LogD (pH 5.5): -5.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 341 Å2
Polarizability:
Surface Tension:
Molar Volume:

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