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Search term: NYYIGJQYEWZYJP-VIFPVBQESA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 5-{[(2S)-2-Aminopropyl]amino}-3-(1H-indol-2-yl)-2-pyrazinecarboxamide | C16H18N6O

5-{[(2S)-2-Aminopropyl]amino}-3-(1H-indol-2-yl)-2-pyrazinecarboxamide

  • Molecular FormulaC16H18N6O
  • Average mass310.354 Da
  • Monoisotopic mass310.154205 Da
  • ChemSpider ID59053163

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-Pyrazinecarboxamide, 5-[[(2S)-2-aminopropyl]amino]-3-(1H-indol-2-yl)- [ACD/Index Name]
5-{[(2S)-2-Aminopropyl]amino}-3-(1H-indol-2-yl)-2-pyrazincarboxamid [German] [ACD/IUPAC Name]
5-{[(2S)-2-Aminopropyl]amino}-3-(1H-indol-2-yl)-2-pyrazinecarboxamide [ACD/IUPAC Name]
5-{[(2S)-2-Aminopropyl]amino}-3-(1H-indol-2-yl)-2-pyrazinecarboxamide [French] [ACD/IUPAC Name]
5-{[(2s)-2-Aminopropyl]amino}-3-(1h-Indol-2-Yl)pyrazine-2-Carboxamide
7CU

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

Density: 1.4±0.1 g/cm3
Boiling Point: 610.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.7±3.0 kJ/mol
Flash Point: 323.1±31.5 °C
Index of Refraction: 1.722
Molar Refractivity: 90.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 1.88
ACD/LogD (pH 5.5): -1.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.62
Polar Surface Area: 123 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 74.2±3.0 dyne/cm
Molar Volume: 228.8±3.0 cm3

Click to predict properties on the Chemicalize site


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