ChemSpider 2D Image | 1,5-Anhydro-2,6-dideoxy-3,4-O-isopropylidene-2-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-6-{[(1-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridazinyl)carbonyl]amino}-D-altritol | C20H27N5O7

1,5-Anhydro-2,6-dideoxy-3,4-O-isopropylidene-2-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-6-{[(1-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridazinyl)carbonyl]amino}-D-altritol

  • Molecular FormulaC20H27N5O7
  • Average mass449.458 Da
  • Monoisotopic mass449.191040 Da
  • ChemSpider ID80832378

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1,5-Anhydro-2,6-dideoxy-3,4-O-isopropylidene-2-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-6-{[(1-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridazinyl)carbonyl]amino}-D-altritol [ACD/IUPAC Name]
1,5-Anhydro-2,6-didesoxy-3,4-O-isopropyliden-2-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-6-{[(1-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridazinyl)carbonyl]amino}-D-altritol [German] [ACD/IUPAC Name]
1,5-Anhydro-2,6-didésoxy-3,4-O-isopropylidène-2-(5-méthyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-6-{[(1-méthyl-6-oxo-1,4,5,6-tétrahydro-3-pyridazinyl)carbonyl]amino}-D-altritol [French] [ACD/IUPAC Name]
D-Altritol, 1,5-anhydro-2,6-dideoxy-2-(3,4-dihydro-5-methyl-2,4-dioxo-1(2H)-pyrimidinyl)-3,4-O-(1-methylethylidene)-6-[[(1,4,5,6-tetrahydro-1-methyl-6-oxo-3-pyridazinyl)carbonyl]amino]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.686
Molar Refractivity: 109.0±0.5 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -1.74
ACD/LogD (pH 5.5): -1.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.11
ACD/LogD (pH 7.4): -1.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.01
Polar Surface Area: 139 Å2
Polarizability: 43.2±0.5 10-24cm3
Surface Tension: 60.8±7.0 dyne/cm
Molar Volume: 286.4±7.0 cm3

Click to predict properties on the Chemicalize site


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