ChemSpider 2D Image | N-Allyl-N-({2-[(cyclohexylmethyl)sulfonyl]-1-(2-methoxyethyl)-1H-imidazol-5-yl}methyl)-2-propen-1-amine | C20H33N3O3S

N-Allyl-N-({2-[(cyclohexylmethyl)sulfonyl]-1-(2-methoxyethyl)-1H-imidazol-5-yl}methyl)-2-propen-1-amine

  • Molecular FormulaC20H33N3O3S
  • Average mass395.559 Da
  • Monoisotopic mass395.224274 Da
  • ChemSpider ID22245328

More details:






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

1H-Imidazole-5-methanamine, 2-[(cyclohexylmethyl)sulfonyl]-1-(2-methoxyethyl)-N,N-di-2-propen-1-yl- [ACD/Index Name]
N-Allyl-N-({2-[(cyclohexylmethyl)sulfonyl]-1-(2-methoxyethyl)-1H-imidazol-5-yl}methyl)-2-propen-1-amin [German] [ACD/IUPAC Name]
N-Allyl-N-({2-[(cyclohexylmethyl)sulfonyl]-1-(2-methoxyethyl)-1H-imidazol-5-yl}methyl)-2-propen-1-amine [ACD/IUPAC Name]
N-Allyl-N-({2-[(cyclohexylméthyl)sulfonyl]-1-(2-méthoxyéthyl)-1H-imidazol-5-yl}méthyl)-2-propén-1-amine [French] [ACD/IUPAC Name]
{[2-CYCLOHEXYLMETHANESULFONYL-1-(2-METHOXYETHYL)-1H-IMIDAZOL-5-YL]METHYL}BIS(PROP-2-EN-1-YL)AMINE
{[2-CYCLOHEXYLMETHANESULFONYL-3-(2-METHOXYETHYL)IMIDAZOL-4-YL]METHYL}BIS(PROP-2-EN-1-YL)AMINE
N-allyl-N-{[2-[(cyclohexylmethyl)sulfonyl]-1-(2-methoxyethyl)-1H-imidazol-5-yl]methyl}-2-propen-1-amine

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 526.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.0±3.0 kJ/mol
Flash Point: 271.9±32.9 °C
Index of Refraction: 1.552
Molar Refractivity: 111.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 3.91
ACD/LogD (pH 5.5): 2.83
ACD/BCF (pH 5.5): 47.78
ACD/KOC (pH 5.5): 289.65
ACD/LogD (pH 7.4): 3.77
ACD/BCF (pH 7.4): 421.38
ACD/KOC (pH 7.4): 2554.41
Polar Surface Area: 73 Å2
Polarizability: 44.1±0.5 10-24cm3
Surface Tension: 41.4±7.0 dyne/cm
Molar Volume: 347.9±7.0 cm3

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