Found 1 result

Search term: InChIKey=KZNMUKLEOMANLY-HKUMRIAESA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 5-{[(3-Methyl-2-buten-1-yl)amino]methyl}-1-(beta-D-ribofuranosyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone | C15H23N3O5S

5-{[(3-Methyl-2-buten-1-yl)amino]methyl}-1-(β-D-ribofuranosyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone

  • Molecular FormulaC15H23N3O5S
  • Average mass357.425 Da
  • Monoisotopic mass357.135834 Da
  • ChemSpider ID107449054
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

4(1H)-Pyrimidinone, 2,3-dihydro-5-[[(3-methyl-2-buten-1-yl)amino]methyl]-1-β-D-ribofuranosyl-2-thioxo- [ACD/Index Name]
5-{[(3-Methyl-2-buten-1-yl)amino]methyl}-1-(β-D-ribofuranosyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinon [German] [ACD/IUPAC Name]
5-{[(3-Methyl-2-buten-1-yl)amino]methyl}-1-(β-D-ribofuranosyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone [ACD/IUPAC Name]
5-{[(3-Méthyl-2-butén-1-yl)amino]méthyl}-1-(β-D-ribofuranosyl)-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone [French] [ACD/IUPAC Name]
872710-78-6 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.654
Molar Refractivity: 91.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 0.81
ACD/LogD (pH 5.5): -2.79
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.98
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 146 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 76.4±5.0 dyne/cm
Molar Volume: 249.4±5.0 cm3

Click to predict properties on the Chemicalize site






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