ChemSpider 2D Image | [4-(6,7-Dihydro-5H-cyclopenta[c]pyridazin-3-yl)-1-piperazinyl]{1-[6-(1H-1,2,4-triazol-1-yl)-3-pyridazinyl]-3-piperidinyl}methanone | C23H28N10O

[4-(6,7-Dihydro-5H-cyclopenta[c]pyridazin-3-yl)-1-piperazinyl]{1-[6-(1H-1,2,4-triazol-1-yl)-3-pyridazinyl]-3-piperidinyl}methanone

  • Molecular FormulaC23H28N10O
  • Average mass460.535 Da
  • Monoisotopic mass460.244751 Da
  • ChemSpider ID58325607

More details:

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

[4-(6,7-Dihydro-5H-cyclopenta[c]pyridazin-3-yl)-1-piperazinyl]{1-[6-(1H-1,2,4-triazol-1-yl)-3-pyridazinyl]-3-piperidinyl}methanon [German] [ACD/IUPAC Name]
[4-(6,7-Dihydro-5H-cyclopenta[c]pyridazin-3-yl)-1-piperazinyl]{1-[6-(1H-1,2,4-triazol-1-yl)-3-pyridazinyl]-3-piperidinyl}methanone [ACD/IUPAC Name]
[4-(6,7-Dihydro-5H-cyclopenta[c]pyridazin-3-yl)-1-pipérazinyl]{1-[6-(1H-1,2,4-triazol-1-yl)-3-pyridazinyl]-3-pipéridinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, [4-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)-1-piperazinyl][1-[6-(1H-1,2,4-triazol-1-yl)-3-pyridazinyl]-3-piperidinyl]- [ACD/Index Name]
(1-(6-(1H-1,2,4-triazol-1-yl)pyridazin-3-yl)piperidin-3-yl)(4-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)piperazin-1-yl)methanone

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

Density: 1.5±0.1 g/cm3
Boiling Point: 869.0±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 126.3±3.0 kJ/mol
Flash Point: 479.4±37.1 °C
Index of Refraction: 1.800
Molar Refractivity: 128.3±0.5 cm3
#H bond acceptors: 11
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -0.85
ACD/LogD (pH 5.5): -0.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.12
ACD/LogD (pH 7.4): 0.55
ACD/BCF (pH 7.4): 1.49
ACD/KOC (pH 7.4): 44.88
Polar Surface Area: 109 Å2
Polarizability: 50.8±0.5 10-24cm3
Surface Tension: 72.1±7.0 dyne/cm
Molar Volume: 300.1±7.0 cm3

Click to predict properties on the Chemicalize site


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