ChemSpider 2D Image | (3-Iodo-4-pyridinyl)[4-(3-pyridinylmethyl)-1-piperazinyl]methanone | C16H17IN4O

(3-Iodo-4-pyridinyl)[4-(3-pyridinylmethyl)-1-piperazinyl]methanone

  • Molecular FormulaC16H17IN4O
  • Average mass408.237 Da
  • Monoisotopic mass408.044708 Da
  • ChemSpider ID29798954

More details:

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

(3-Iod-4-pyridinyl)[4-(3-pyridinylmethyl)-1-piperazinyl]methanon [German] [ACD/IUPAC Name]
(3-Iodo-4-pyridinyl)[4-(3-pyridinylmethyl)-1-piperazinyl]methanone [ACD/IUPAC Name]
(3-Iodo-4-pyridinyl)[4-(3-pyridinylméthyl)-1-pipérazinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, (3-iodo-4-pyridinyl)[4-(3-pyridinylmethyl)-1-piperazinyl]- [ACD/Index Name]
1-(3-IODOPYRIDINE-4-CARBONYL)-4-(PYRIDIN-3-YLMETHYL)PIPERAZINE
1-(3-IODOPYRIDINE-4-CARBONYL)-4-[(PYRIDIN-3-YL)METHYL]PIPERAZINE

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

Density: 1.6±0.1 g/cm3
Boiling Point: 534.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.0±3.0 kJ/mol
Flash Point: 276.8±30.1 °C
Index of Refraction: 1.663
Molar Refractivity: 93.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.26
ACD/LogD (pH 5.5): 0.79
ACD/BCF (pH 5.5): 2.01
ACD/KOC (pH 5.5): 48.03
ACD/LogD (pH 7.4): 1.05
ACD/BCF (pH 7.4): 3.68
ACD/KOC (pH 7.4): 88.21
Polar Surface Area: 49 Å2
Polarizability: 37.1±0.5 10-24cm3
Surface Tension: 63.0±3.0 dyne/cm
Molar Volume: 252.4±3.0 cm3

Click to predict properties on the Chemicalize site


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