ChemSpider 2D Image | N-({1-Benzyl-2-[(2-fluorobenzyl)sulfonyl]-1H-imidazol-5-yl}methyl)-N-(cyclopropylmethyl)-2-thiophenecarboxamide | C27H26FN3O3S2

N-({1-Benzyl-2-[(2-fluorobenzyl)sulfonyl]-1H-imidazol-5-yl}methyl)-N-(cyclopropylmethyl)-2-thiophenecarboxamide

  • Molecular FormulaC27H26FN3O3S2
  • Average mass523.642 Da
  • Monoisotopic mass523.139954 Da
  • ChemSpider ID22609576

More details:

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

2-Thiophenecarboxamide, N-(cyclopropylmethyl)-N-[[2-[[(2-fluorophenyl)methyl]sulfonyl]-1-(phenylmethyl)-1H-imidazol-5-yl]methyl]- [ACD/Index Name]
N-({1-Benzyl-2-[(2-fluorbenzyl)sulfonyl]-1H-imidazol-5-yl}methyl)-N-(cyclopropylmethyl)-2-thiophencarboxamid [German] [ACD/IUPAC Name]
N-({1-Benzyl-2-[(2-fluorobenzyl)sulfonyl]-1H-imidazol-5-yl}methyl)-N-(cyclopropylmethyl)-2-thiophenecarboxamide [ACD/IUPAC Name]
N-({1-Benzyl-2-[(2-fluorobenzyl)sulfonyl]-1H-imidazol-5-yl}méthyl)-N-(cyclopropylméthyl)-2-thiophènecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 757.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.3±3.0 kJ/mol
Flash Point: 411.8±35.7 °C
Index of Refraction: 1.667
Molar Refractivity: 143.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.30
ACD/LogD (pH 5.5): 4.11
ACD/BCF (pH 5.5): 781.08
ACD/KOC (pH 5.5): 4094.41
ACD/LogD (pH 7.4): 4.11
ACD/BCF (pH 7.4): 781.09
ACD/KOC (pH 7.4): 4094.47
Polar Surface Area: 109 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 54.5±7.0 dyne/cm
Molar Volume: 385.4±7.0 cm3

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