ChemSpider 2D Image | 1-(2-Biphenylyl)-3-[1-(3-{methyl[(1R)-1-(1-naphthyl)ethyl]amino}propyl)-4-piperidinyl]urea | C34H40N4O

1-(2-Biphenylyl)-3-[1-(3-{methyl[(1R)-1-(1-naphthyl)ethyl]amino}propyl)-4-piperidinyl]urea

  • Molecular FormulaC34H40N4O
  • Average mass520.708 Da
  • Monoisotopic mass520.320190 Da
  • ChemSpider ID8294370

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-(2-Biphenylyl)-3-[1-(3-{methyl[(1R)-1-(1-naphthyl)ethyl]amino}propyl)-4-piperidinyl]harnstoff [German] [ACD/IUPAC Name]
1-(2-Biphenylyl)-3-[1-(3-{methyl[(1R)-1-(1-naphthyl)ethyl]amino}propyl)-4-piperidinyl]urea [ACD/IUPAC Name]
1-(2-Biphénylyl)-3-[1-(3-{méthyl[(1R)-1-(1-naphtyl)éthyl]amino}propyl)-4-pipéridinyl]urée [French] [ACD/IUPAC Name]
Urea, N-[1,1'-biphenyl]-2-yl-N'-[1-[3-[methyl[(1R)-1-(1-naphthalenyl)ethyl]amino]propyl]-4-piperidinyl]- [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: 659.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.1±3.0 kJ/mol
Flash Point: 352.8±31.5 °C
Index of Refraction: 1.653
Molar Refractivity: 162.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.33
ACD/LogD (pH 5.5): 2.58
ACD/BCF (pH 5.5): 5.64
ACD/KOC (pH 5.5): 8.41
ACD/LogD (pH 7.4): 4.65
ACD/BCF (pH 7.4): 673.88
ACD/KOC (pH 7.4): 1004.03
Polar Surface Area: 48 Å2
Polarizability: 64.4±0.5 10-24cm3
Surface Tension: 56.4±5.0 dyne/cm
Molar Volume: 443.7±5.0 cm3

Click to predict properties on the Chemicalize site


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