ChemSpider 2D Image | 1-{2,5-Dideoxy-5-[(iodoacetyl)amino]pentofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidinedione | C12H16IN3O5

1-{2,5-Dideoxy-5-[(iodoacetyl)amino]pentofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC12H16IN3O5
  • Average mass409.177 Da
  • Monoisotopic mass409.013458 Da
  • ChemSpider ID23109817

More details:






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

1-{2,5-Dideoxy-5-[(iodoacetyl)amino]pentofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-{2,5-Didésoxy-5-[(2-iodoacétyl)amino]pentofuranosyl}-5-méthyl-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
1-{2,5-Didesoxy-5-[(iodacetyl)amino]pentofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-[2,5-dideoxy-5-[(2-iodoacetyl)amino]pentofuranosyl]-5-methyl- [ACD/Index Name]
1-{2,5-dideoxy-5-[(iodoacetyl)amino]pentofuranosyl}-5-methylpyrimidine-2,4(1H,3H)-dione
N-[3-Hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-tetrahydro-furan-2-ylmethyl]-2-iodo-acetamide

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.624
Molar Refractivity: 80.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.19
ACD/LogD (pH 5.5): -0.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.20
ACD/LogD (pH 7.4): -0.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.14
Polar Surface Area: 108 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 63.5±3.0 dyne/cm
Molar Volume: 227.1±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement