ChemSpider 2D Image | 5-({5-Amino-4-[(3-amino-3-phenylpropyl)amino]-2-pyridinyl}amino)-2-pyrazinecarbonitrile | C19H20N8

5-({5-Amino-4-[(3-amino-3-phenylpropyl)amino]-2-pyridinyl}amino)-2-pyrazinecarbonitrile

  • Molecular FormulaC19H20N8
  • Average mass360.416 Da
  • Monoisotopic mass360.181091 Da
  • ChemSpider ID30776175

More details:






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

2-Pyrazinecarbonitrile, 5-[[5-amino-4-[(3-amino-3-phenylpropyl)amino]-2-pyridinyl]amino]- [ACD/Index Name]
5-({5-Amino-4-[(3-amino-3-phenylpropyl)amino]-2-pyridinyl}amino)-2-pyrazincarbonitril [German] [ACD/IUPAC Name]
5-({5-Amino-4-[(3-amino-3-phenylpropyl)amino]-2-pyridinyl}amino)-2-pyrazinecarbonitrile [ACD/IUPAC Name]
5-({5-Amino-4-[(3-amino-3-phénylpropyl)amino]-2-pyridinyl}amino)-2-pyrazinecarbonitrile [French] [ACD/IUPAC Name]
1137476-48-2 [RN]
5-((5-Amino-4-((3-amino-3-phenylpropyl)amino)pyridin-2-yl)amino)pyrazine-2-carbonitrile
5-({5-AMINO-4-[(3-AMINO-3-PHENYLPROPYL)AMINO]PYRIDIN-2-YL}AMINO)PYRAZINE-2-CARBONITRILE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 648.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.7±3.0 kJ/mol
Flash Point: 346.2±31.5 °C
Index of Refraction: 1.687
Molar Refractivity: 102.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.49
ACD/LogD (pH 5.5): -1.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.12
Polar Surface Area: 139 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 84.5±5.0 dyne/cm
Molar Volume: 269.2±5.0 cm3

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