ChemSpider 2D Image | 5'-O-[(Benzylamino){2-[(3-hydroxy-2,2-dimethylpropanoyl)sulfanyl]ethoxy}phosphoryl]-2'-C-methyl-4,5-dihydroguanosine | C25H37N6O9PS

5'-O-[(Benzylamino){2-[(3-hydroxy-2,2-dimethylpropanoyl)sulfanyl]ethoxy}phosphoryl]-2'-C-methyl-4,5-dihydroguanosine

  • Molecular FormulaC25H37N6O9PS
  • Average mass628.635 Da
  • Monoisotopic mass628.208008 Da
  • ChemSpider ID57524700

  • defined stereocentres - 4 of 7 defined stereocentres

More details:

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

4,5-Dihydroguanosine, 5'-O-[[2-[(3-hydroxy-2,2-dimethyl-1-oxopropyl)thio]ethoxy][(phenylmethyl)amino]phosphinyl]-2'-C-methyl- [ACD/Index Name]
5'-O-[(Benzylamino){2-[(3-hydroxy-2,2-dimethylpropanoyl)sulfanyl]ethoxy}phosphoryl]-2'-C-methyl-4,5-dihydroguanosin [German] [ACD/IUPAC Name]
5'-O-[(Benzylamino){2-[(3-hydroxy-2,2-dimethylpropanoyl)sulfanyl]ethoxy}phosphoryl]-2'-C-methyl-4,5-dihydroguanosine [ACD/IUPAC Name]
5'-O-[(Benzylamino){2-[(3-hydroxy-2,2-diméthylpropanoyl)sulfanyl]éthoxy}phosphoryl]-2'-C-méthyl-4,5-dihydroguanosine [French] [ACD/IUPAC Name]
1207451-95-3 [RN]
IDX 184

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: 1.690
Molar Refractivity: 150.1±0.5 cm3
#H bond acceptors: 15
#H bond donors: 7
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: -0.95
ACD/LogD (pH 5.5): -1.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.43
Polar Surface Area: 253 Å2
Polarizability: 59.5±0.5 10-24cm3
Surface Tension: 71.3±7.0 dyne/cm
Molar Volume: 392.7±7.0 cm3

Click to predict properties on the Chemicalize site


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