ChemSpider 2D Image | [4-(4-{[2-(3,4-Dimethoxyphenyl)ethyl]amino}-1-piperidinyl)phenyl](3-hydroxy-1-piperidinyl)methanone | C27H37N3O4

[4-(4-{[2-(3,4-Dimethoxyphenyl)ethyl]amino}-1-piperidinyl)phenyl](3-hydroxy-1-piperidinyl)methanone

  • Molecular FormulaC27H37N3O4
  • Average mass467.600 Da
  • Monoisotopic mass467.278412 Da
  • ChemSpider ID22137541

More details:

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

[4-(4-{[2-(3,4-Dimethoxyphenyl)ethyl]amino}-1-piperidinyl)phenyl](3-hydroxy-1-piperidinyl)methanon [German] [ACD/IUPAC Name]
[4-(4-{[2-(3,4-Dimethoxyphenyl)ethyl]amino}-1-piperidinyl)phenyl](3-hydroxy-1-piperidinyl)methanone [ACD/IUPAC Name]
[4-(4-{[2-(3,4-Diméthoxyphényl)éthyl]amino}-1-pipéridinyl)phényl](3-hydroxy-1-pipéridinyl)méthanone [French] [ACD/IUPAC Name]
Methanone, [4-[4-[[2-(3,4-dimethoxyphenyl)ethyl]amino]-1-piperidinyl]phenyl](3-hydroxy-1-piperidinyl)- [ACD/Index Name]
1-[4-(4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-piperidinyl)benzoyl]-3-piperidinol

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

Density: 1.2±0.1 g/cm3
Boiling Point: 674.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.1±3.0 kJ/mol
Flash Point: 361.8±31.5 °C
Index of Refraction: 1.613
Molar Refractivity: 133.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.02
ACD/LogD (pH 5.5): -0.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.23
Polar Surface Area: 74 Å2
Polarizability: 52.9±0.5 10-24cm3
Surface Tension: 57.3±5.0 dyne/cm
Molar Volume: 383.1±5.0 cm3

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