ChemSpider 2D Image | N-[3-(3,5-Dimethyl-1-piperidinyl)propyl]-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydro-4-isoquinolinecarboxamide | C34H41N3O4

N-[3-(3,5-Dimethyl-1-piperidinyl)propyl]-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydro-4-isoquinolinecarboxamide

  • Molecular FormulaC34H41N3O4
  • Average mass555.707 Da
  • Monoisotopic mass555.309692 Da
  • ChemSpider ID22467015

More details:

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

4-Isoquinolinecarboxamide, N-[3-(3,5-dimethyl-1-piperidinyl)propyl]-1,2,3,4-tetrahydro-2,3-bis(4-methoxyphenyl)-1-oxo- [ACD/Index Name]
N-[3-(3,5-Dimethyl-1-piperidinyl)propyl]-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydro-4-isochinolincarboxamid [German] [ACD/IUPAC Name]
N-[3-(3,5-Diméthyl-1-pipéridinyl)propyl]-2,3-bis(4-méthoxyphényl)-1-oxo-1,2,3,4-tétrahydro-4-isoquinoléinecarboxamide [French] [ACD/IUPAC Name]
N-[3-(3,5-Dimethyl-1-piperidinyl)propyl]-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydro-4-isoquinolinecarboxamide [ACD/IUPAC 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: 742.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.3±3.0 kJ/mol
Flash Point: 402.8±32.9 °C
Index of Refraction: 1.573
Molar Refractivity: 160.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 6.20
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 3.55
ACD/KOC (pH 5.5): 11.81
ACD/LogD (pH 7.4): 3.05
ACD/BCF (pH 7.4): 40.78
ACD/KOC (pH 7.4): 135.71
Polar Surface Area: 71 Å2
Polarizability: 63.6±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 486.8±3.0 cm3

Click to predict properties on the Chemicalize site


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