ChemSpider 2D Image | N-(Phenylcarbamoyl)-9-[2,3-O-(2-phenylethylidene)-5-O-phosphono-D-glycero-pentofuranosyl]-9H-purin-6-amine | C25H25N6O8P

N-(Phenylcarbamoyl)-9-[2,3-O-(2-phenylethylidene)-5-O-phosphono-D-glycero-pentofuranosyl]-9H-purin-6-amine

  • Molecular FormulaC25H25N6O8P
  • Average mass568.475 Da
  • Monoisotopic mass568.147156 Da
  • ChemSpider ID9803097

  • defined stereocentres - 1 of 5 defined stereocentres

More details:

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

9H-Purin-6-amine, N-[(phenylamino)carbonyl]-9-[2,3-O-(2-phenylethylidene)-5-O-phosphono-D-glycero-pentofuranosyl]- [ACD/Index Name]
N-(Phenylcarbamoyl)-9-[2,3-O-(2-phenylethyliden)-5-O-phosphono-D-glycero-pentofuranosyl]-9H-purin-6-amin [German] [ACD/IUPAC Name]
N-(Phenylcarbamoyl)-9-[2,3-O-(2-phenylethylidene)-5-O-phosphono-D-glycero-pentofuranosyl]-9H-purin-6-amine [ACD/IUPAC Name]
N-(Phénylcarbamoyl)-9-[2,3-O-(2-phényléthylidène)-5-O-phosphono-D-glycéro-pentofuranosyl]-9H-purin-6-amine [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.763
Molar Refractivity: 137.5±0.5 cm3
#H bond acceptors: 14
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 3.34
ACD/LogD (pH 5.5): -2.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 189 Å2
Polarizability: 54.5±0.5 10-24cm3
Surface Tension: 79.8±7.0 dyne/cm
Molar Volume: 333.1±7.0 cm3

Click to predict properties on the Chemicalize site


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