ChemSpider 2D Image | N-[(2S)-1-Amino-1-oxo-2-pentanyl]-1-(cyclohexylmethyl)-1H-indazole-3-carboxamide | C20H28N4O2

N-[(2S)-1-Amino-1-oxo-2-pentanyl]-1-(cyclohexylmethyl)-1H-indazole-3-carboxamide

  • Molecular FormulaC20H28N4O2
  • Average mass356.462 Da
  • Monoisotopic mass356.221222 Da
  • ChemSpider ID114876967

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1H-Indazole-3-carboxamide, N-[(1S)-1-(aminocarbonyl)butyl]-1-(cyclohexylmethyl)- [ACD/Index Name]
N-[(2S)-1-Amino-1-oxo-2-pentanyl]-1-(cyclohexylmethyl)-1H-indazol-3-carboxamid [German] [ACD/IUPAC Name]
N-[(2S)-1-Amino-1-oxo-2-pentanyl]-1-(cyclohexylmethyl)-1H-indazole-3-carboxamide [ACD/IUPAC Name]
N-[(2S)-1-Amino-1-oxo-2-pentanyl]-1-(cyclohexylméthyl)-1H-indazole-3-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 631.8±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.4±3.0 kJ/mol
Flash Point: 335.9±25.9 °C
Index of Refraction: 1.639
Molar Refractivity: 100.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.65
ACD/LogD (pH 5.5): 3.18
ACD/BCF (pH 5.5): 153.53
ACD/KOC (pH 5.5): 1277.84
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 153.44
ACD/KOC (pH 7.4): 1277.13
Polar Surface Area: 90 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 50.9±7.0 dyne/cm
Molar Volume: 279.6±7.0 cm3

Click to predict properties on the Chemicalize site


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