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Search term: BXVGZYZWBNOETO (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 1,5-Anhydro-2,3-dideoxy-4-O-[2-(dimethylamino)ethyl]-3-{[(4-methyl-1,2,5-oxadiazol-3-yl)acetyl]amino}-D-threo-pentitol | C14H24N4O4

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

  • Molecular FormulaC14H24N4O4
  • Average mass312.365 Da
  • Monoisotopic mass312.179749 Da
  • ChemSpider ID35086279
  • 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-{[(4-methyl-1,2,5-oxadiazol-3-yl)acetyl]amino}-D-threo-pentitol [ACD/IUPAC Name]
1,5-Anhydro-2,3-didesoxy-4-O-[2-(dimethylamino)ethyl]-3-{[(4-methyl-1,2,5-oxadiazol-3-yl)acetyl]amino}-D-threo-pentitol [German] [ACD/IUPAC Name]
1,5-Anhydro-2,3-didésoxy-4-O-[2-(diméthylamino)éthyl]-3-{[2-(4-méthyl-1,2,5-oxadiazol-3-yl)acétyl]amino}-D-thréo-pentitol [French] [ACD/IUPAC Name]
D-threo-Pentitol, 1,5-anhydro-2,3-dideoxy-4-O-[2-(dimethylamino)ethyl]-3-[[2-(4-methyl-1,2,5-oxadiazol-3-yl)acetyl]amino]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.523
Molar Refractivity: 79.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -2.34
ACD/LogD (pH 5.5): -3.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 90 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 51.1±5.0 dyne/cm
Molar Volume: 260.2±5.0 cm3

Click to predict properties on the Chemicalize site






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