ChemSpider 2D Image | 2'-Deoxy-2'-[(3,5-dichlorobenzoyl)amino]-N-(1-naphthylmethyl)adenosine | C28H24Cl2N6O4

2'-Deoxy-2'-[(3,5-dichlorobenzoyl)amino]-N-(1-naphthylmethyl)adenosine

  • Molecular FormulaC28H24Cl2N6O4
  • Average mass579.434 Da
  • Monoisotopic mass578.123596 Da
  • ChemSpider ID8523669

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

2'-Deoxy-2'-[(3,5-dichlorobenzoyl)amino]-N-(1-naphthylmethyl)adenosine [ACD/IUPAC Name]
2'-deoxy-2'-[(3,5-dichlorobenzoyl)amino]-N-(naphthalen-1-ylmethyl)adenosine
2'-Desoxy-2'-[(3,5-dichlorbenzoyl)amino]-N-(1-naphthylmethyl)adenosin [German] [ACD/IUPAC Name]
2'-Désoxy-2'-[(3,5-dichlorobenzoyl)amino]-N-(1-naphtylméthyl)adénosine [French] [ACD/IUPAC Name]
Adenosine, 2'-deoxy-2'-[(3,5-dichlorobenzoyl)amino]-N-(1-naphthalenylmethyl)- [ACD/Index Name]
3,5-Dichloro-N-(4-hydroxy-5-hydroxymethyl-2-{6-[(naphthalen-1-ylmethyl)-amino]-9H-purin-3-ylmethyl}-tetrahydro-furan-3-yl)-benzamide
CHEMBL294813
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL294813/

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: 1.756
Molar Refractivity: 148.7±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: 5.56
ACD/LogD (pH 5.5): 4.75
ACD/BCF (pH 5.5): 2410.83
ACD/KOC (pH 5.5): 9157.78
ACD/LogD (pH 7.4): 4.76
ACD/BCF (pH 7.4): 2425.33
ACD/KOC (pH 7.4): 9212.89
Polar Surface Area: 134 Å2
Polarizability: 58.9±0.5 10-24cm3
Surface Tension: 65.9±7.0 dyne/cm
Molar Volume: 362.7±7.0 cm3

Click to predict properties on the Chemicalize site


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