ChemSpider 2D Image | N-{[2-(Benzylsulfonyl)-1-isobutyl-1H-imidazol-5-yl]methyl}-N-[2-(4-morpholinyl)ethyl]-2-thiophenecarboxamide | C26H34N4O4S2

N-{[2-(Benzylsulfonyl)-1-isobutyl-1H-imidazol-5-yl]methyl}-N-[2-(4-morpholinyl)ethyl]-2-thiophenecarboxamide

  • Molecular FormulaC26H34N4O4S2
  • Average mass530.703 Da
  • Monoisotopic mass530.202148 Da
  • ChemSpider ID22636409

More details:

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

2-Thiophenecarboxamide, N-[[1-(2-methylpropyl)-2-[(phenylmethyl)sulfonyl]-1H-imidazol-5-yl]methyl]-N-[2-(4-morpholinyl)ethyl]- [ACD/Index Name]
N-{[2-(Benzylsulfonyl)-1-isobutyl-1H-imidazol-5-yl]methyl}-N-[2-(4-morpholinyl)ethyl]-2-thiophencarboxamid [German] [ACD/IUPAC Name]
N-{[2-(Benzylsulfonyl)-1-isobutyl-1H-imidazol-5-yl]methyl}-N-[2-(4-morpholinyl)ethyl]-2-thiophenecarboxamide [ACD/IUPAC Name]
N-{[2-(Benzylsulfonyl)-1-isobutyl-1H-imidazol-5-yl]méthyl}-N-[2-(4-morpholinyl)éthyl]-2-thiophènecarboxamide [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: 744.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.5±3.0 kJ/mol
Flash Point: 404.0±35.7 °C
Index of Refraction: 1.633
Molar Refractivity: 146.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 2.43
ACD/LogD (pH 5.5): 2.30
ACD/BCF (pH 5.5): 20.59
ACD/KOC (pH 5.5): 173.26
ACD/LogD (pH 7.4): 3.12
ACD/BCF (pH 7.4): 137.01
ACD/KOC (pH 7.4): 1152.98
Polar Surface Area: 121 Å2
Polarizability: 58.1±0.5 10-24cm3
Surface Tension: 51.9±7.0 dyne/cm
Molar Volume: 410.5±7.0 cm3

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