ChemSpider 2D Image | N-[4-(Dimethylamino)phenyl]-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydro-4-isoquinolinecarboxamide | C32H31N3O4

N-[4-(Dimethylamino)phenyl]-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydro-4-isoquinolinecarboxamide

  • Molecular FormulaC32H31N3O4
  • Average mass521.606 Da
  • Monoisotopic mass521.231445 Da
  • ChemSpider ID4236332

More details:

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

4-Isoquinolinecarboxamide, N-[4-(dimethylamino)phenyl]-1,2,3,4-tetrahydro-2,3-bis(4-methoxyphenyl)-1-oxo- [ACD/Index Name]
N-[4-(Dimethylamino)phenyl]-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydro-4-isochinolincarboxamid [German] [ACD/IUPAC Name]
N-[4-(Diméthylamino)phényl]-2,3-bis(4-méthoxyphényl)-1-oxo-1,2,3,4-tétrahydro-4-isoquinoléinecarboxamide [French] [ACD/IUPAC Name]
N-[4-(Dimethylamino)phenyl]-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydro-4-isoquinolinecarboxamide [ACD/IUPAC Name]
(2,3-bis(4-methoxyphenyl)-1-oxo(4-2,3,4-trihydroisoquinolyl))-N-(4-(dimethylamino)phenyl)formamide
[2,3-bis(4-methoxyphenyl)-1-oxo(4-2,3,4-trihydroisoquinolyl)]-N-[4-(dimethylamino)phenyl]carboxamide
1024289-66-4 [RN]
MFCD03839795 [MDL number]
MS-10460
N-[4-(dimethylamino)phenyl]-2,3-bis(4-methoxyphenyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 748.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.1±3.0 kJ/mol
Flash Point: 406.3±32.9 °C
Index of Refraction: 1.652
Molar Refractivity: 152.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.78
ACD/LogD (pH 5.5): 4.81
ACD/BCF (pH 5.5): 2018.27
ACD/KOC (pH 5.5): 5799.75
ACD/LogD (pH 7.4): 5.30
ACD/BCF (pH 7.4): 6299.08
ACD/KOC (pH 7.4): 18101.15
Polar Surface Area: 71 Å2
Polarizability: 60.4±0.5 10-24cm3
Surface Tension: 55.4±3.0 dyne/cm
Molar Volume: 416.8±3.0 cm3

Click to predict properties on the Chemicalize site


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