ChemSpider 2D Image | 1,5-Anhydro-2,3-dideoxy-4-O-[2-(dimethylamino)ethyl]-3-{[3-(1,2-oxazolidin-2-yl)propanoyl]amino}-D-threo-pentitol | C15H29N3O4

1,5-Anhydro-2,3-dideoxy-4-O-[2-(dimethylamino)ethyl]-3-{[3-(1,2-oxazolidin-2-yl)propanoyl]amino}-D-threo-pentitol

  • Molecular FormulaC15H29N3O4
  • Average mass315.409 Da
  • Monoisotopic mass315.215820 Da
  • ChemSpider ID35090244

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1,5-Anhydro-2,3-dideoxy-4-O-[2-(dimethylamino)ethyl]-3-{[3-(1,2-oxazolidin-2-yl)propanoyl]amino}-D-threo-pentitol [ACD/IUPAC Name]
1,5-Anhydro-2,3-didesoxy-4-O-[2-(dimethylamino)ethyl]-3-{[3-(1,2-oxazolidin-2-yl)propanoyl]amino}-D-threo-pentitol [German] [ACD/IUPAC Name]
1,5-Anhydro-2,3-didésoxy-4-O-[2-(diméthylamino)éthyl]-3-{[3-(1,2-oxazolidin-2-yl)propanoyl]amino}-D-thréo-pentitol [French] [ACD/IUPAC Name]
D-threo-Pentitol, 1,5-anhydro-2,3-dideoxy-4-O-[2-(dimethylamino)ethyl]-3-[[3-(2-isoxazolidinyl)-1-oxopropyl]amino]- [ACD/Index Name]
1,5-anhydro-2,3-dideoxy-4-O-[2-(dimethylamino)ethyl]-3-[(3-isoxazolidin-2-ylpropanoyl)amino]-D-threo-pentitol

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.522
Molar Refractivity: 84.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: -2.45
ACD/LogD (pH 5.5): -3.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 63 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 45.2±5.0 dyne/cm
Molar Volume: 275.7±5.0 cm3

Click to predict properties on the Chemicalize site


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