ChemSpider 2D Image | N-[1-({(2S)-4-Acetamido-3-oxo-1-[(3S)-2-oxo-3-pyrrolidinyl]-2-butanyl}amino)-4-methyl-1-oxo-2-pentanyl]-4-methoxy-1H-indole-2-carboxamide | C26H35N5O6

N-[1-({(2S)-4-Acetamido-3-oxo-1-[(3S)-2-oxo-3-pyrrolidinyl]-2-butanyl}amino)-4-methyl-1-oxo-2-pentanyl]-4-methoxy-1H-indole-2-carboxamide

  • Molecular FormulaC26H35N5O6
  • Average mass513.586 Da
  • Monoisotopic mass513.258728 Da
  • ChemSpider ID9795242

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

1H-Indole-2-carboxamide, N-[1-[[[(1S)-3-(acetylamino)-2-oxo-1-[[(3S)-2-oxo-3-pyrrolidinyl]methyl]propyl]amino]carbonyl]-3-methylbutyl]-4-methoxy- [ACD/Index Name]
N-[1-({(2S)-4-Acetamido-3-oxo-1-[(3S)-2-oxo-3-pyrrolidinyl]-2-butanyl}amino)-4-methyl-1-oxo-2-pentanyl]-4-methoxy-1H-indol-2-carboxamid [German] [ACD/IUPAC Name]
N-[1-({(2S)-4-Acetamido-3-oxo-1-[(3S)-2-oxo-3-pyrrolidinyl]-2-butanyl}amino)-4-methyl-1-oxo-2-pentanyl]-4-methoxy-1H-indole-2-carboxamide [ACD/IUPAC Name]
N-[1-({(2S)-4-Acétamido-3-oxo-1-[(3S)-2-oxo-3-pyrrolidinyl]-2-butanyl}amino)-4-méthyl-1-oxo-2-pentanyl]-4-méthoxy-1H-indole-2-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 932.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 135.8±3.0 kJ/mol
Flash Point: 517.9±34.3 °C
Index of Refraction: 1.573
Molar Refractivity: 136.9±0.3 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 1.47
ACD/LogD (pH 5.5): 0.76
ACD/BCF (pH 5.5): 2.23
ACD/KOC (pH 5.5): 61.80
ACD/LogD (pH 7.4): 0.76
ACD/BCF (pH 7.4): 2.23
ACD/KOC (pH 7.4): 61.80
Polar Surface Area: 158 Å2
Polarizability: 54.3±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 415.2±3.0 cm3

Click to predict properties on the Chemicalize site


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