ChemSpider 2D Image | 1-Cyano-2-{(1S)-1-[(4-~3~H)phenyl]ethyl}-3-(5-quinolinyl)guanidine | C19H16TN5

1-Cyano-2-{(1S)-1-[(4-3H)phenyl]ethyl}-3-(5-quinolinyl)guanidine

  • Molecular FormulaC19H16TN5
  • Average mass317.380 Da
  • Monoisotopic mass317.156616 Da
  • ChemSpider ID24635666

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

1-(5-Chinolinyl)-2-cyan-3-{(1S)-1-[(4-3H)phenyl]ethyl}guanidin [German] [ACD/IUPAC Name]
1-Cyano-2-{(1S)-1-[(4-3H)phényl]éthyl}-3-(5-quinoléinyl)guanidine [French] [ACD/IUPAC Name]
1-Cyano-2-{(1S)-1-[(4-3H)phenyl]ethyl}-3-(5-quinolinyl)guanidine [ACD/IUPAC Name]
Guanidine, N''-cyano-N-[(1S)-1-(phenyl-4-t)ethyl]-N'-5-quinolinyl- [ACD/Index Name]
(Z)-2-cyano-3-[(1S)-1-[(4-3H)phenyl]ethyl]-1-(quinolin-5-yl)guanidine
(Z)-2-cyano-3-[(1S)-1-[(4-³H)phenyl]ethyl]-1-(quinolin-5-yl)guanidine
[3H]A 804598
[3H]A804598
[³H]A804598
A-804598

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

Density:
Boiling Point: 498.0±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 255.0±29.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.02
ACD/LogD (pH 5.5): 2.75
ACD/BCF (pH 5.5): 70.84
ACD/KOC (pH 5.5): 710.33
ACD/LogD (pH 7.4): 2.80
ACD/BCF (pH 7.4): 79.61
ACD/KOC (pH 7.4): 798.23
Polar Surface Area: 73 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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