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Search term: XNIWXZNBHJGVPA-UBEDBUPSSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 5'-({[4-Amino-1-(methoxymethyl)-2-oxo-1,2-dihydro-5-pyrimidinyl]methyl}amino)-5'-deoxyadenosine | C17H23N9O5

5'-({[4-Amino-1-(methoxymethyl)-2-oxo-1,2-dihydro-5-pyrimidinyl]methyl}amino)-5'-deoxyadenosine

  • Molecular FormulaC17H23N9O5
  • Average mass433.422 Da
  • Monoisotopic mass433.182220 Da
  • ChemSpider ID61709227

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

5'-({[4-Amino-1-(methoxymethyl)-2-oxo-1,2-dihydro-5-pyrimidinyl]methyl}amino)-5'-deoxyadenosine [ACD/IUPAC Name]
5'-({[4-Amino-1-(methoxymethyl)-2-oxo-1,2-dihydro-5-pyrimidinyl]methyl}amino)-5'-desoxyadenosin [German] [ACD/IUPAC Name]
5'-({[4-Amino-1-(méthoxyméthyl)-2-oxo-1,2-dihydro-5-pyrimidinyl]méthyl}amino)-5'-désoxyadénosine [French] [ACD/IUPAC Name]
5'-Deoxy-5'-({[4-imino-1-(methoxymethyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinyl]methyl}amino)adenosine [ACD/IUPAC Name]
5'-Desoxy-5'-({[4-imino-1-(methoxymethyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinyl]methyl}amino)adenosin [German] [ACD/IUPAC Name]
5'-Désoxy-5'-({[4-imino-1-(méthoxyméthyl)-2-oxo-1,2,3,4-tétrahydro-5-pyrimidinyl]méthyl}amino)adénosine [French] [ACD/IUPAC Name]
Adenosine, 5'-[[[4-amino-1,2-dihydro-1-(methoxymethyl)-2-oxo-5-pyrimidinyl]methyl]amino]-5'-deoxy- [ACD/Index Name]
Adenosine, 5'-deoxy-5'-[[[1,2,3,4-tetrahydro-4-imino-1-(methoxymethyl)-2-oxo-5-pyrimidinyl]methyl]amino]- [ACD/Index Name]
5-[[[(2{r},3{s},4{r},5{r})-5-(6-Aminopurin-9-Yl)-3,4-Bis(Oxidanyl)oxolan-2-Yl]methylamino]methyl]-4-Azanyl-1-(Methoxymethyl)pyrimidin-2-One
LHB

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: 1.828
Molar Refractivity: 102.9±0.5 cm3
#H bond acceptors: 14
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -1.48
ACD/LogD (pH 5.5): -3.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 197 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 89.0±7.0 dyne/cm
Molar Volume: 234.6±7.0 cm3

Click to predict properties on the Chemicalize site


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