Found 164 results

Search term: MF = 'C_{35}H_{40}N_{4}O'
ChemSpider 2D Image | 3-(1,4'-Bipiperidin-1'-ylmethyl)-2-phenyl-N-[(1S)-1-phenylethyl]-4-quinolinecarboxamide | C35H40N4O

3-(1,4'-Bipiperidin-1'-ylmethyl)-2-phenyl-N-[(1S)-1-phenylethyl]-4-quinolinecarboxamide

  • Molecular FormulaC35H40N4O
  • Average mass532.718 Da
  • Monoisotopic mass532.320190 Da
  • ChemSpider ID76795719

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

3-(1,4'-Bipiperidin-1'-ylmethyl)-2-phenyl-N-[(1S)-1-phenylethyl]-4-chinolincarboxamid [German] [ACD/IUPAC Name]
3-(1,4'-Bipipéridin-1'-ylméthyl)-2-phényl-N-[(1S)-1-phényléthyl]-4-quinoléinecarboxamide [French] [ACD/IUPAC Name]
3-(1,4'-Bipiperidin-1'-ylmethyl)-2-phenyl-N-[(1S)-1-phenylethyl]-4-quinolinecarboxamide [ACD/IUPAC Name]
4-Quinolinecarboxamide, 3-([1,4'-bipiperidin]-1'-ylmethyl)-2-phenyl-N-[(1S)-1-phenylethyl]- [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: 688.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.9±3.0 kJ/mol
Flash Point: 370.2±31.5 °C
Index of Refraction: 1.634
Molar Refractivity: 163.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.34
ACD/LogD (pH 5.5): 2.92
ACD/BCF (pH 5.5): 17.30
ACD/KOC (pH 5.5): 34.51
ACD/LogD (pH 7.4): 4.15
ACD/BCF (pH 7.4): 294.39
ACD/KOC (pH 7.4): 587.18
Polar Surface Area: 48 Å2
Polarizability: 64.9±0.5 10-24cm3
Surface Tension: 52.4±3.0 dyne/cm
Molar Volume: 457.9±3.0 cm3

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