ChemSpider 2D Image | (4-Benzyl-1-piperazinyl){1-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinyl}methanone | C29H33N7O

(4-Benzyl-1-piperazinyl){1-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinyl}methanone

  • Molecular FormulaC29H33N7O
  • Average mass495.619 Da
  • Monoisotopic mass495.274658 Da
  • ChemSpider ID28959608

More details:

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

(4-Benzyl-1-piperazinyl){1-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinyl}methanon [German] [ACD/IUPAC Name]
(4-Benzyl-1-piperazinyl){1-[3-(3-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-piperidinyl}methanone [ACD/IUPAC Name]
(4-Benzyl-1-pipérazinyl){1-[3-(3-méthylphényl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-4-pipéridinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, [1-[3-(3-methylphenyl)-1,2,4-triazolo[4,3-b]pyridazin-6-yl]-4-piperidinyl][4-(phenylmethyl)-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.695
Molar Refractivity: 146.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.80
ACD/LogD (pH 5.5): 2.49
ACD/BCF (pH 5.5): 35.24
ACD/KOC (pH 5.5): 327.14
ACD/LogD (pH 7.4): 2.95
ACD/BCF (pH 7.4): 102.09
ACD/KOC (pH 7.4): 947.63
Polar Surface Area: 70 Å2
Polarizability: 58.1±0.5 10-24cm3
Surface Tension: 55.1±7.0 dyne/cm
Molar Volume: 381.4±7.0 cm3

Click to predict properties on the Chemicalize site


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