ChemSpider 2D Image | 6-Amino-2-[(2S)-2-pentanyloxy]-9-[5-(1-piperidinyl)pentyl]-7,9-dihydro-8H-purin-8-one | C20H34N6O2

6-Amino-2-[(2S)-2-pentanyloxy]-9-[5-(1-piperidinyl)pentyl]-7,9-dihydro-8H-purin-8-one

  • Molecular FormulaC20H34N6O2
  • Average mass390.523 Da
  • Monoisotopic mass390.274323 Da
  • ChemSpider ID58145180

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

6-Amino-2-[(2S)-2-pentanyloxy]-9-[5-(1-piperidinyl)pentyl]-7,9-dihydro-8H-purin-8-on [German] [ACD/IUPAC Name]
6-Amino-2-[(2S)-2-pentanyloxy]-9-[5-(1-piperidinyl)pentyl]-7,9-dihydro-8H-purin-8-one [ACD/IUPAC Name]
6-Amino-2-[(2S)-2-pentanyloxy]-9-[5-(1-pipéridinyl)pentyl]-7,9-dihydro-8H-purin-8-one [French] [ACD/IUPAC Name]
8H-Purin-8-one, 6-amino-7,9-dihydro-2-[(1S)-1-methylbutoxy]-9-[5-(1-piperidinyl)pentyl]- [ACD/Index Name]
1207629-49-9 [RN]
1207629-49-9 (free base)
6-amino-2-[(2S)-pentan-2-yloxy]-9-[5-(piperidin-1-yl)pentyl]-8,9-dihydro-7H-purin-8-one
compound 32 [PMID: 26861551]
GSK2245035

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.555
Molar Refractivity: 109.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.37
ACD/LogD (pH 5.5): 0.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.30
ACD/LogD (pH 7.4): 1.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.46
Polar Surface Area: 97 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 49.2±3.0 dyne/cm
Molar Volume: 341.9±3.0 cm3

Click to predict properties on the Chemicalize site


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