ChemSpider 2D Image | N-[(2S)-3-Methyl-1-oxo-1-{[2-(2-pyridinyl)ethyl]amino}-2-butanyl]-3-(4-morpholinylsulfonyl)benzamide | C23H30N4O5S

N-[(2S)-3-Methyl-1-oxo-1-{[2-(2-pyridinyl)ethyl]amino}-2-butanyl]-3-(4-morpholinylsulfonyl)benzamide

  • Molecular FormulaC23H30N4O5S
  • Average mass474.573 Da
  • Monoisotopic mass474.193695 Da
  • ChemSpider ID115234741

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Benzamide, N-[(1S)-2-methyl-1-[[[2-(2-pyridinyl)ethyl]amino]carbonyl]propyl]-3-(4-morpholinylsulfonyl)- [ACD/Index Name]
N-[(2S)-3-Methyl-1-oxo-1-{[2-(2-pyridinyl)ethyl]amino}-2-butanyl]-3-(4-morpholinylsulfonyl)benzamid [German] [ACD/IUPAC Name]
N-[(2S)-3-Methyl-1-oxo-1-{[2-(2-pyridinyl)ethyl]amino}-2-butanyl]-3-(4-morpholinylsulfonyl)benzamide [ACD/IUPAC Name]
N-[(2S)-3-Méthyl-1-oxo-1-{[2-(2-pyridinyl)éthyl]amino}-2-butanyl]-3-(4-morpholinylsulfonyl)benzamide [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.578
Molar Refractivity: 124.7±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.20
ACD/LogD (pH 5.5): 1.36
ACD/BCF (pH 5.5): 5.90
ACD/KOC (pH 5.5): 113.72
ACD/LogD (pH 7.4): 1.49
ACD/BCF (pH 7.4): 7.95
ACD/KOC (pH 7.4): 153.33
Polar Surface Area: 126 Å2
Polarizability: 49.4±0.5 10-24cm3
Surface Tension: 52.5±3.0 dyne/cm
Molar Volume: 375.8±3.0 cm3

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