ChemSpider 2D Image | 5-(Ammoniomethyl)-1-(beta-D-ribofuranosyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone | C10H16N3O5S

5-(Ammoniomethyl)-1-(β-D-ribofuranosyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone

  • Molecular FormulaC10H16N3O5S
  • Average mass290.316 Da
  • Monoisotopic mass290.080505 Da
  • ChemSpider ID34448477
  • Charge - Charge

    defined stereocentres - 4 of 4 defined stereocentres


More details:






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

4(1H)-Pyrimidinone, 5-(aminomethyl)-2,3-dihydro-1-β-D-ribofuranosyl-2-thioxo-, conjugate monoacid [ACD/Index Name]
5-(Ammoniomethyl)-1-(β-D-ribofuranosyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinon [German] [ACD/IUPAC Name]
5-(Ammoniomethyl)-1-(β-D-ribofuranosyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone [ACD/IUPAC Name]
5-(Ammoniométhyl)-1-(β-D-ribofuranosyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone [French] [ACD/IUPAC Name]
5-(azaniumylmethyl)-1-(β-D-ribofuranosyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
  • Miscellaneous
    • Chemical Class:

      An organic cation obtained by protonation of the exocyclic amino group of 5-aminomethyl-2-thiouridine. ChEBI CHEBI:73769

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: 8
#H bond donors: 6
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -1.27
ACD/LogD (pH 5.5): -4.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 162 Å2
Polarizability:
Surface Tension:
Molar Volume:

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