ChemSpider 2D Image | 5'-O-{[5-(7-Hydroxy-3-oxo-3H-phenoxazin-2-yl)pentanoyl]sulfamoyl}adenosine | C27H27N7O10S

5'-O-{[5-(7-Hydroxy-3-oxo-3H-phenoxazin-2-yl)pentanoyl]sulfamoyl}adenosine

  • Molecular FormulaC27H27N7O10S
  • Average mass641.609 Da
  • Monoisotopic mass641.153992 Da
  • ChemSpider ID35035081

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

5'-O-{[5-(7-Hydroxy-3-oxo-3H-phenoxazin-2-yl)pentanoyl]sulfamoyl}adenosin [German] [ACD/IUPAC Name]
5'-O-{[5-(7-Hydroxy-3-oxo-3H-phenoxazin-2-yl)pentanoyl]sulfamoyl}adenosine [ACD/IUPAC Name]
5'-O-{[5-(7-Hydroxy-3-oxo-3H-phénoxazin-2-yl)pentanoyl]sulfamoyl}adénosine [French] [ACD/IUPAC Name]
Adenosine, 5'-O-[[[5-(7-hydroxy-3-oxo-3H-phenoxazin-2-yl)-1-oxopentyl]amino]sulfonyl]- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.803
Molar Refractivity: 151.0±0.5 cm3
#H bond acceptors: 17
#H bond donors: 6
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 1.03
ACD/LogD (pH 5.5): -0.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.53
ACD/LogD (pH 7.4): -0.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.36
Polar Surface Area: 259 Å2
Polarizability: 59.9±0.5 10-24cm3
Surface Tension: 86.7±7.0 dyne/cm
Molar Volume: 352.3±7.0 cm3

Click to predict properties on the Chemicalize site


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