ChemSpider 2D Image | 2-Amino-8-[2-Oxo-2-(4-Phenylphenyl)ethyl]sulfanyl-1,9-Dihydropurin-6-One | C19H15N5O2S

2-Amino-8-[2-Oxo-2-(4-Phenylphenyl)ethyl]sulfanyl-1,9-Dihydropurin-6-One

  • Molecular FormulaC19H15N5O2S
  • Average mass377.420 Da
  • Monoisotopic mass377.094635 Da
  • ChemSpider ID35034621

More details:






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

2-Amino-8-[2-Oxo-2-(4-Phenylphenyl)ethyl]sulfanyl-1,9-Dihydropurin-6-One
2-Amino-8-{[2-(4-biphenylyl)-2-oxoethyl]sulfanyl}-1,9-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
2-Amino-8-{[2-(4-biphenylyl)-2-oxoethyl]sulfanyl}-1,9-dihydro-6H-purin-6-one [ACD/IUPAC Name]
2-Amino-8-{[2-(4-biphénylyl)-2-oxoéthyl]sulfanyl}-1,9-dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]
6H-Purin-6-one, 2-amino-8-[(2-[1,1'-biphenyl]-4-yl-2-oxoethyl)thio]-1,9-dihydro- [ACD/Index Name]
X6L

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: 1.771
Molar Refractivity: 103.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.74
ACD/LogD (pH 5.5): 2.63
ACD/BCF (pH 5.5): 58.21
ACD/KOC (pH 5.5): 638.10
ACD/LogD (pH 7.4): 2.61
ACD/BCF (pH 7.4): 56.30
ACD/KOC (pH 7.4): 617.25
Polar Surface Area: 139 Å2
Polarizability: 41.1±0.5 10-24cm3
Surface Tension: 68.3±7.0 dyne/cm
Molar Volume: 249.0±7.0 cm3

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