Found 1 result

Search term: NDAJDUOUMGSWSD-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 8-(2-Furyl)-3-{2-[4-(4-methoxyphenyl)-1-piperazinyl]ethyl}-3H-[1,2,4]triazolo[5,1-i]purin-5-amine | C23H25N9O2

8-(2-Furyl)-3-{2-[4-(4-methoxyphenyl)-1-piperazinyl]ethyl}-3H-[1,2,4]triazolo[5,1-i]purin-5-amine

  • Molecular FormulaC23H25N9O2
  • Average mass459.504 Da
  • Monoisotopic mass459.213135 Da
  • ChemSpider ID23302229

More details:

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

3H-[1,2,4]Triazolo[5,1-i]purin-5-amine, 8-(2-furanyl)-3-[2-[4-(4-methoxyphenyl)-1-piperazinyl]ethyl]- [ACD/Index Name]
8-(2-Furyl)-3-{2-[4-(4-methoxyphenyl)-1-piperazinyl]ethyl}-3H-[1,2,4]triazolo[5,1-i]purin-5-amin [German] [ACD/IUPAC Name]
8-(2-Furyl)-3-{2-[4-(4-methoxyphenyl)-1-piperazinyl]ethyl}-3H-[1,2,4]triazolo[5,1-i]purin-5-amine [ACD/IUPAC Name]
8-(2-Furyl)-3-{2-[4-(4-méthoxyphényl)-1-pipérazinyl]éthyl}-3H-[1,2,4]triazolo[5,1-i]purin-5-amine [French] [ACD/IUPAC Name]
8-(furan-2-yl)-3-{2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}-3H-[1,2,4]triazolo[5,1-i]purin-5-amine
8-(furan-2-yl)-3-(2-(4-(4-methoxyphenyl)piperazin-1-yl)ethyl)-3H-[1,2,4]triazolo[1,5-g]purin-5-amine
CHEMBL245848

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: 1.772
Molar Refractivity: 125.8±0.5 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 1.45
ACD/LogD (pH 5.5): -0.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.15
ACD/LogD (pH 7.4): 1.20
ACD/BCF (pH 7.4): 4.48
ACD/KOC (pH 7.4): 94.32
Polar Surface Area: 116 Å2
Polarizability: 49.9±0.5 10-24cm3
Surface Tension: 67.7±7.0 dyne/cm
Molar Volume: 302.2±7.0 cm3

Click to predict properties on the Chemicalize site


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