ChemSpider 2D Image | 5'-Deoxy-5'-{[(2E,4E)-5-{2'''-[(E)-2-(2-methylcyclopropyl)vinyl]-1,1':2',1'':2'',1'''-quater(cyclopropan)-2-yl}-2,4-pentadienoyl]amino}-5,6-dihydrouridine | C32H43N3O6

5'-Deoxy-5'-{[(2E,4E)-5-{2'''-[(E)-2-(2-methylcyclopropyl)vinyl]-1,1':2',1'':2'',1'''-quater(cyclopropan)-2-yl}-2,4-pentadienoyl]amino}-5,6-dihydrouridine

  • Molecular FormulaC32H43N3O6
  • Average mass565.700 Da
  • Monoisotopic mass565.315186 Da
  • ChemSpider ID4979530

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 14 defined stereocentres

More details:

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

5,6-Dihydrouridine, 5'-deoxy-5'-[[(2E,4E)-5-[2'''-[(E)-2-(2-methylcyclopropyl)ethenyl][1,1':2',1'':2'',1'''-quatercyclopropan]-2-yl]-1-oxo-2,4-pentadien-1-yl]amino]- [ACD/Index Name]
5'-Deoxy-5'-{[(2E,4E)-5-{2'''-[(E)-2-(2-methylcyclopropyl)vinyl]-1,1':2',1'':2'',1'''-quater(cyclopropan)-2-yl}-2,4-pentadienoyl]amino}-5,6-dihydrouridine [ACD/IUPAC Name]
5'-Desoxy-5'-{[(2E,4E)-5-{2'''-[(E)-2-(2-methylcyclopropyl)vinyl]-1,1':2',1'':2'',1'''-quater(cyclopropan)-2-yl}-2,4-pentadienoyl]amino}-5,6-dihydrouridin [German] [ACD/IUPAC Name]
5'-Désoxy-5'-{[(2E,4E)-5-{2'''-[(E)-2-(2-méthylcyclopropyl)vinyl]-1,1':2',1'':2'',1'''-quater(cyclopropan)-2-yl}-2,4-pentadienoyl]amino}-5,6-dihydrouridine [French] [ACD/IUPAC Name]
5-{2-[2-(2-{2-[(1E)-2-(2-Methylcyclopropyl)vinyl]cyclopropyl}cyclopropyl)cyclopropyl]cyclopropyl}(2E,4E)-N-{[5-(2,4-dioxo(1,3,5,6-tetrahydropyrimidinyl))-3,4-dihydroxyoxolan-2-yl]methyl}penta-2,4-dienamide

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

AIDS165387 [DBID]
AIDS-165387 [DBID]
FR-900848 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.750
Molar Refractivity: 157.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 2.62
ACD/LogD (pH 5.5): 2.51
ACD/BCF (pH 5.5): 47.56
ACD/KOC (pH 5.5): 552.31
ACD/LogD (pH 7.4): 2.51
ACD/BCF (pH 7.4): 47.56
ACD/KOC (pH 7.4): 552.30
Polar Surface Area: 128 Å2
Polarizability: 62.3±0.5 10-24cm3
Surface Tension: 91.5±3.0 dyne/cm
Molar Volume: 385.6±3.0 cm3

Click to predict properties on the Chemicalize site


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