ChemSpider 2D Image | (4-{7-[(4-Fluorophenyl)amino]-1H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}-1-piperazinyl)(2-furyl)methanone | C19H17FN8O2

(4-{7-[(4-Fluorophenyl)amino]-1H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}-1-piperazinyl)(2-furyl)methanone

  • Molecular FormulaC19H17FN8O2
  • Average mass408.389 Da
  • Monoisotopic mass408.145844 Da
  • ChemSpider ID26305123

More details:

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

(4-{7-[(4-Fluorophenyl)amino]-1H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}-1-piperazinyl)(2-furyl)methanone [ACD/IUPAC Name]
(4-{7-[(4-Fluorophényl)amino]-1H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}-1-pipérazinyl)(2-furyl)méthanone [French] [ACD/IUPAC Name]
(4-{7-[(4-Fluorphenyl)amino]-1H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}-1-piperazinyl)(2-furyl)methanon [German] [ACD/IUPAC Name]
Methanone, [4-[7-[(4-fluorophenyl)amino]-3H-1,2,3-triazolo[4,5-d]pyrimidin-5-yl]-1-piperazinyl]-2-furanyl- [ACD/Index Name]
(4-(7-((4-fluorophenyl)amino)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl)piperazin-1-yl)(furan-2-yl)methanone
(4-{7-[(4-fluorophenyl)amino]-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl}piperazin-1-yl)(furan-2-yl)methanone
{4-[7-(4-Fluoro-phenylamino)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl]-piperazin-1-yl}-furan-2-yl-methanone
1286728-81-1 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 743.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.4±3.0 kJ/mol
Flash Point: 403.5±35.7 °C
Index of Refraction: 1.721
Molar Refractivity: 106.0±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 0.67
ACD/LogD (pH 5.5): 0.69
ACD/BCF (pH 5.5): 1.20
ACD/KOC (pH 5.5): 22.18
ACD/LogD (pH 7.4): 1.24
ACD/BCF (pH 7.4): 4.34
ACD/KOC (pH 7.4): 80.43
Polar Surface Area: 116 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 86.4±3.0 dyne/cm
Molar Volume: 268.2±3.0 cm3

Click to predict properties on the Chemicalize site


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