ChemSpider 2D Image | 5-(6-Oxo-3,6-dihydro-9H-purin-9-yl)pentyl {5-[(diaminomethylene)amino]-1,1-dihydroxy-1-penten-2-yl}carbamate | C17H26N8O5

5-(6-Oxo-3,6-dihydro-9H-purin-9-yl)pentyl {5-[(diaminomethylene)amino]-1,1-dihydroxy-1-penten-2-yl}carbamate

  • Molecular FormulaC17H26N8O5
  • Average mass422.439 Da
  • Monoisotopic mass422.202606 Da
  • ChemSpider ID95586879

More details:

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

{5-[(Diaminométhylène)amino]-1,1-dihydroxy-1-pentén-2-yl}carbamate de 5-(6-oxo-3,6-dihydro-9H-purin-9-yl)pentyle [French] [ACD/IUPAC Name]
5-(6-Oxo-3,6-dihydro-9H-purin-9-yl)pentyl {5-[(diaminomethylene)amino]-1,1-dihydroxy-1-penten-2-yl}carbamate [ACD/IUPAC Name]
5-(6-Oxo-3,6-dihydro-9H-purin-9-yl)pentyl-{5-[(diaminomethylen)amino]-1,1-dihydroxy-1-penten-2-yl}carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[4-[(diaminomethylene)amino]-1-(dihydroxymethylene)butyl]-, 5-(3,6-dihydro-6-oxo-9H-purin-9-yl)pentyl ester [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.685
Molar Refractivity: 103.6±0.5 cm3
#H bond acceptors: 13
#H bond donors: 8
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: -0.09
ACD/LogD (pH 5.5): -2.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 202 Å2
Polarizability: 41.1±0.5 10-24cm3
Surface Tension: 70.6±7.0 dyne/cm
Molar Volume: 272.6±7.0 cm3

Click to predict properties on the Chemicalize site


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