ChemSpider 2D Image | 4,6-Dimethyl-N'-(3-Pyridin-2-Ylisoquinolin-1-Yl)pyrimidine-2-Carboximidamide | C21H18N6

4,6-Dimethyl-N'-(3-Pyridin-2-Ylisoquinolin-1-Yl)pyrimidine-2-Carboximidamide

  • Molecular FormulaC21H18N6
  • Average mass354.408 Da
  • Monoisotopic mass354.159302 Da
  • ChemSpider ID23219575

More details:






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

2-Pyrimidinecarboximidamide, 4,6-dimethyl-N-[3-(2-pyridinyl)-1-isoquinolinyl]- [ACD/Index Name]
4,6-Dimethyl-N'-(3-Pyridin-2-Ylisoquinolin-1-Yl)pyrimidine-2-Carboximidamide
4,6-Dimethyl-N-[3-(2-pyridinyl)-1-isochinolinyl]-2-pyrimidincarboximidamid [German] [ACD/IUPAC Name]
4,6-Diméthyl-N-[3-(2-pyridinyl)-1-isoquinoléinyl]-2-pyrimidinecarboximidamide [French] [ACD/IUPAC Name]
4,6-Dimethyl-N-[3-(2-pyridinyl)-1-isoquinolinyl]-2-pyrimidinecarboximidamide [ACD/IUPAC Name]
4,6-dimethyl-N-[3-(pyridin-2-yl)isoquinolin-1-yl]pyrimidine-2-carboximidamide
083
4,6-Dimethyl-N-(3-pyridin-2-yl-isoquinolin-1-yl)-pyrimidine-2-carboxamidine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 581.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.0±3.0 kJ/mol
Flash Point: 305.8±32.9 °C
Index of Refraction: 1.697
Molar Refractivity: 105.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.01
ACD/LogD (pH 5.5): 2.97
ACD/BCF (pH 5.5): 106.07
ACD/KOC (pH 5.5): 980.13
ACD/LogD (pH 7.4): 2.97
ACD/BCF (pH 7.4): 106.29
ACD/KOC (pH 7.4): 982.11
Polar Surface Area: 87 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 51.5±7.0 dyne/cm
Molar Volume: 275.1±7.0 cm3

Click to predict properties on the Chemicalize site






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