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Search term: BDRUNDKEQQVJJG (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 5'-Deoxy-5'-(dimethylamino)-8-methyladenosine | C13H20N6O3

5'-Deoxy-5'-(dimethylamino)-8-methyladenosine

  • Molecular FormulaC13H20N6O3
  • Average mass308.336 Da
  • Monoisotopic mass308.159698 Da
  • ChemSpider ID23335123

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

5'-Deoxy-5'-(dimethylamino)-8-methyladenosine [ACD/IUPAC Name]
5'-Desoxy-5'-(dimethylamino)-8-methyladenosin [German] [ACD/IUPAC Name]
5'-Désoxy-5'-(diméthylamino)-8-méthyladénosine [French] [ACD/IUPAC Name]
Adenosine, 5'-deoxy-5'-(dimethylamino)-8-methyl- [ACD/Index Name]
5'-Deoxy-5'-(N,N-dimethylamino)-8-methyladenosine
AdoMet substrate analogue, 23a
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL516214/
N8M

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

Density: 1.6±0.1 g/cm3
Boiling Point: 608.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 95.0±3.0 kJ/mol
Flash Point: 321.7±31.5 °C
Index of Refraction: 1.750
Molar Refractivity: 76.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.08
ACD/LogD (pH 5.5): -3.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.05
Polar Surface Area: 123 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 66.3±7.0 dyne/cm
Molar Volume: 187.3±7.0 cm3

Click to predict properties on the Chemicalize site


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