ChemSpider 2D Image | (4R)-4-[(4-Biphenylylmethyl)amino]-N-ethyl-1-(1-propyl-4-piperidinyl)-L-prolinamide | C28H40N4O

(4R)-4-[(4-Biphenylylmethyl)amino]-N-ethyl-1-(1-propyl-4-piperidinyl)-L-prolinamide

  • Molecular FormulaC28H40N4O
  • Average mass448.643 Da
  • Monoisotopic mass448.320221 Da
  • ChemSpider ID22868471

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R)-4-[(4-Biphenylylmethyl)amino]-N-ethyl-1-(1-propyl-4-piperidinyl)-L-prolinamid [German] [ACD/IUPAC Name]
(4R)-4-[(4-Biphenylylmethyl)amino]-N-ethyl-1-(1-propyl-4-piperidinyl)-L-prolinamide [ACD/IUPAC Name]
(4R)-4-[(4-Biphénylylméthyl)amino]-N-éthyl-1-(1-propyl-4-pipéridinyl)-L-prolinamide [French] [ACD/IUPAC Name]
2-Pyrrolidinecarboxamide, 4-[([1,1'-biphenyl]-4-ylmethyl)amino]-N-ethyl-1-(1-propyl-4-piperidinyl)-, (2S,4R)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 627.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.9±3.0 kJ/mol
Flash Point: 333.4±31.5 °C
Index of Refraction: 1.601
Molar Refractivity: 136.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.32
ACD/LogD (pH 5.5): 0.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.46
Polar Surface Area: 48 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 51.0±5.0 dyne/cm
Molar Volume: 399.0±5.0 cm3

Click to predict properties on the Chemicalize site


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