ChemSpider 2D Image | N-Cyclopropyl-3'-[4-(4-isoquinolinylamino)-5-oxo-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl]-3-biphenylcarboxamide | C33H27N5O2

N-Cyclopropyl-3'-[4-(4-isoquinolinylamino)-5-oxo-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl]-3-biphenylcarboxamide

  • Molecular FormulaC33H27N5O2
  • Average mass525.600 Da
  • Monoisotopic mass525.216492 Da
  • ChemSpider ID76751951

More details:

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

[1,1'-Biphenyl]-3-carboxamide, N-cyclopropyl-3'-[5,6,7,8-tetrahydro-4-(4-isoquinolinylamino)-5-oxo-1,6-naphthyridin-2-yl]- [ACD/Index Name]
N-Cyclopropyl-3'-[4-(4-isochinolinylamino)-5-oxo-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl]-3-biphenylcarboxamid [German] [ACD/IUPAC Name]
N-Cyclopropyl-3'-[4-(4-isoquinoléinylamino)-5-oxo-5,6,7,8-tétrahydro-1,6-naphtyridin-2-yl]-3-biphénylcarboxamide [French] [ACD/IUPAC Name]
N-Cyclopropyl-3'-[4-(4-isoquinolinylamino)-5-oxo-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl]-3-biphenylcarboxamide [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 844.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 122.7±3.0 kJ/mol
Flash Point: 464.4±34.3 °C
Index of Refraction: 1.747
Molar Refractivity: 153.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.89
ACD/LogD (pH 5.5): 4.56
ACD/BCF (pH 5.5): 1613.89
ACD/KOC (pH 5.5): 6386.36
ACD/LogD (pH 7.4): 4.67
ACD/BCF (pH 7.4): 2092.77
ACD/KOC (pH 7.4): 8281.35
Polar Surface Area: 96 Å2
Polarizability: 60.9±0.5 10-24cm3
Surface Tension: 79.1±5.0 dyne/cm
Molar Volume: 377.8±5.0 cm3

Click to predict properties on the Chemicalize site


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