ChemSpider 2D Image | N-[3-(4-Benzyl-1-piperidinyl)propyl]-2-[(4-isopropylphenyl)amino]-4-quinolinecarboxamide | C34H40N4O

N-[3-(4-Benzyl-1-piperidinyl)propyl]-2-[(4-isopropylphenyl)amino]-4-quinolinecarboxamide

  • Molecular FormulaC34H40N4O
  • Average mass520.708 Da
  • Monoisotopic mass520.320190 Da
  • ChemSpider ID20255294

More details:

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

4-Quinolinecarboxamide, 2-[[4-(1-methylethyl)phenyl]amino]-N-[3-[4-(phenylmethyl)-1-piperidinyl]propyl]- [ACD/Index Name]
N-[3-(4-Benzyl-1-piperidinyl)propyl]-2-[(4-isopropylphenyl)amino]-4-chinolincarboxamid [German] [ACD/IUPAC Name]
N-[3-(4-Benzyl-1-pipéridinyl)propyl]-2-[(4-isopropylphényl)amino]-4-quinoléinecarboxamide [French] [ACD/IUPAC Name]
N-[3-(4-Benzyl-1-piperidinyl)propyl]-2-[(4-isopropylphenyl)amino]-4-quinolinecarboxamide [ACD/IUPAC Name]
N-[3-(4-BENZYLPIPERIDIN-1-YL)PROPYL]-2-[(4-ISOPROPYLPHENYL)AMINO]QUINOLINE-4-CARBOXAMIDE
N-[3-(4-BENZYLPIPERIDIN-1-YL)PROPYL]-2-{[4-(PROPAN-2-YL)PHENYL]AMINO}QUINOLINE-4-CARBOXAMIDE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 697.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.2±3.0 kJ/mol
Flash Point: 375.9±31.5 °C
Index of Refraction: 1.627
Molar Refractivity: 162.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 7.16
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 85.14
ACD/KOC (pH 5.5): 115.21
ACD/LogD (pH 7.4): 4.92
ACD/BCF (pH 7.4): 1128.71
ACD/KOC (pH 7.4): 1527.26
Polar Surface Area: 57 Å2
Polarizability: 64.4±0.5 10-24cm3
Surface Tension: 50.9±3.0 dyne/cm
Molar Volume: 458.1±3.0 cm3

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