ChemSpider 2D Image | 1-(3-Methoxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)-3-isoquinolinamine | C20H18N4O

1-(3-Methoxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)-3-isoquinolinamine

  • Molecular FormulaC20H18N4O
  • Average mass330.383 Da
  • Monoisotopic mass330.148071 Da
  • ChemSpider ID35034318

More details:






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

1-(3-Methoxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)-3-isochinolinamin [German] [ACD/IUPAC Name]
1-(3-Méthoxyphényl)-N-(5-méthyl-1H-pyrazol-3-yl)-3-isoquinoléinamine [French] [ACD/IUPAC Name]
1-(3-Methoxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)-3-isoquinolinamine [ACD/IUPAC Name]
1-(3-Methoxyphenyl)-N-(5-Methyl-1h-Pyrazol-3-Yl)isoquinolin-3-Amine
3-Isoquinolinamine, 1-(3-methoxyphenyl)-N-(5-methyl-1H-pyrazol-3-yl)- [ACD/Index Name]
RO9

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 549.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.0±3.0 kJ/mol
Flash Point: 286.2±30.1 °C
Index of Refraction: 1.697
Molar Refractivity: 100.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.68
ACD/LogD (pH 5.5): 4.49
ACD/BCF (pH 5.5): 1521.75
ACD/KOC (pH 5.5): 6531.14
ACD/LogD (pH 7.4): 4.51
ACD/BCF (pH 7.4): 1577.89
ACD/KOC (pH 7.4): 6772.10
Polar Surface Area: 63 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 58.9±3.0 dyne/cm
Molar Volume: 259.9±3.0 cm3

Click to predict properties on the Chemicalize site






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