Found 1 result

Search term: PRSGLZGIXQBAJL (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1,4'-Bipiperidin-1'-yl{6-methyl-2-[1-(4-nitrobenzoyl)-4-piperidinyl]-3-pyridinyl}methanone | C29H37N5O4

1,4'-Bipiperidin-1'-yl{6-methyl-2-[1-(4-nitrobenzoyl)-4-piperidinyl]-3-pyridinyl}methanone

  • Molecular FormulaC29H37N5O4
  • Average mass519.635 Da
  • Monoisotopic mass519.284546 Da
  • ChemSpider ID22722289

More details:

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

1,4'-Bipiperidin-1'-yl{6-methyl-2-[1-(4-nitrobenzoyl)-4-piperidinyl]-3-pyridinyl}methanon [German] [ACD/IUPAC Name]
1,4'-Bipiperidin-1'-yl{6-methyl-2-[1-(4-nitrobenzoyl)-4-piperidinyl]-3-pyridinyl}methanone [ACD/IUPAC Name]
1,4'-Bipipéridin-1'-yl{6-méthyl-2-[1-(4-nitrobenzoyl)-4-pipéridinyl]-3-pyridinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, [1,4'-bipiperidin]-1'-yl[6-methyl-2-[1-(4-nitrobenzoyl)-4-piperidinyl]-3-pyridinyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 718.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.0±3.0 kJ/mol
Flash Point: 388.3±32.9 °C
Index of Refraction: 1.613
Molar Refractivity: 144.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 2.05
ACD/LogD (pH 5.5): -0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.34
ACD/BCF (pH 7.4): 2.80
ACD/KOC (pH 7.4): 28.67
Polar Surface Area: 103 Å2
Polarizability: 57.4±0.5 10-24cm3
Surface Tension: 57.1±3.0 dyne/cm
Molar Volume: 416.3±3.0 cm3

Click to predict properties on the Chemicalize site


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