ChemSpider 2D Image | (1-{6-[(3-Methoxyphenyl)sulfanyl]-3-pyridazinyl}-4-piperidinyl)[4-(2-pyridinyl)-1-piperazinyl]methanone | C26H30N6O2S

(1-{6-[(3-Methoxyphenyl)sulfanyl]-3-pyridazinyl}-4-piperidinyl)[4-(2-pyridinyl)-1-piperazinyl]methanone

  • Molecular FormulaC26H30N6O2S
  • Average mass490.620 Da
  • Monoisotopic mass490.215088 Da
  • ChemSpider ID26310792

More details:

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

(1-{6-[(3-Methoxyphenyl)sulfanyl]-3-pyridazinyl}-4-piperidinyl)[4-(2-pyridinyl)-1-piperazinyl]methanon [German] [ACD/IUPAC Name]
(1-{6-[(3-Methoxyphenyl)sulfanyl]-3-pyridazinyl}-4-piperidinyl)[4-(2-pyridinyl)-1-piperazinyl]methanone [ACD/IUPAC Name]
(1-{6-[(3-Méthoxyphényl)sulfanyl]-3-pyridazinyl}-4-pipéridinyl)[4-(2-pyridinyl)-1-pipérazinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, [1-[6-[(3-methoxyphenyl)thio]-3-pyridazinyl]-4-piperidinyl][4-(2-pyridinyl)-1-piperazinyl]- [ACD/Index Name]
(1-(6-((3-methoxyphenyl)thio)pyridazin-3-yl)piperidin-4-yl)(4-(pyridin-2-yl)piperazin-1-yl)methanone
[1-[6-(3-methoxyphenyl)sulfanylpyridazin-3-yl]piperidin-4-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone
1223902-87-1 [RN]
3-[(3-methoxyphenyl)sulfanyl]-6-{4-[4-(pyridin-2-yl)piperazine-1-carbonyl]piperidin-1-yl}pyridazine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 783.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.0±3.0 kJ/mol
Flash Point: 427.7±32.9 °C
Index of Refraction: 1.680
Molar Refractivity: 137.9±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.19
ACD/LogD (pH 5.5): 1.09
ACD/BCF (pH 5.5): 1.05
ACD/KOC (pH 5.5): 7.61
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 20.69
ACD/KOC (pH 7.4): 149.38
Polar Surface Area: 100 Å2
Polarizability: 54.7±0.5 10-24cm3
Surface Tension: 74.2±5.0 dyne/cm
Molar Volume: 364.9±5.0 cm3

Click to predict properties on the Chemicalize site


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