ChemSpider 2D Image | AB-PICA | C19H27N3O2

AB-PICA

  • Molecular FormulaC19H27N3O2
  • Average mass329.437 Da
  • Monoisotopic mass329.210327 Da
  • ChemSpider ID57427399
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

1H-Indole-3-carboxamide, N-[(1S)-1-(aminocarbonyl)-2-methylpropyl]-1-pentyl- [ACD/Index Name]
AB-PICA [Wiki]
N-[(2S)-1-Amino-3-methyl-1-oxo-2-butanyl]-1-pentyl-1H-indol-3-carboxamid [German] [ACD/IUPAC Name]
N-[(2S)-1-Amino-3-methyl-1-oxo-2-butanyl]-1-pentyl-1H-indole-3-carboxamide [ACD/IUPAC Name]
N-[(2S)-1-Amino-3-méthyl-1-oxo-2-butanyl]-1-pentyl-1H-indole-3-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 594.0±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.5±3.0 kJ/mol
Flash Point: 313.0±24.6 °C
Index of Refraction: 1.580
Molar Refractivity: 95.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.81
ACD/LogD (pH 5.5): 3.81
ACD/BCF (pH 5.5): 466.42
ACD/KOC (pH 5.5): 2830.82
ACD/LogD (pH 7.4): 3.81
ACD/BCF (pH 7.4): 466.42
ACD/KOC (pH 7.4): 2830.81
Polar Surface Area: 77 Å2
Polarizability: 37.7±0.5 10-24cm3
Surface Tension: 42.2±7.0 dyne/cm
Molar Volume: 285.6±7.0 cm3

Click to predict properties on the Chemicalize site






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