ChemSpider 2D Image | 2-Methyl-2-propanyl {1-[{1-(4-ethylphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}(5-methyl-2-hexanyl)amino]-1-oxo-3-sulfanyl-2-propanyl}carbamate | C32H47N3O5S

2-Methyl-2-propanyl {1-[{1-(4-ethylphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}(5-methyl-2-hexanyl)amino]-1-oxo-3-sulfanyl-2-propanyl}carbamate

  • Molecular FormulaC32H47N3O5S
  • Average mass585.798 Da
  • Monoisotopic mass585.323669 Da
  • ChemSpider ID16550449

More details:

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

{1-[{1-(4-Éthylphényl)-2-[(4-méthoxyphényl)amino]-2-oxoéthyl}(5-méthyl-2-hexanyl)amino]-1-oxo-3-sulfanyl-2-propanyl}carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl {1-[{1-(4-ethylphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}(5-methyl-2-hexanyl)amino]-1-oxo-3-sulfanyl-2-propanyl}carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-{1-[{1-(4-ethylphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}(5-methyl-2-hexanyl)amino]-1-oxo-3-sulfanyl-2-propanyl}carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[2-[(1,4-dimethylpentyl)[1-(4-ethylphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl]amino]-1-(mercaptomethyl)-2-oxoethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.552
Molar Refractivity: 166.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 8.97
ACD/LogD (pH 5.5): 6.76
ACD/BCF (pH 5.5): 80367.21
ACD/KOC (pH 5.5): 112584.94
ACD/LogD (pH 7.4): 6.61
ACD/BCF (pH 7.4): 56971.25
ACD/KOC (pH 7.4): 79809.98
Polar Surface Area: 139 Å2
Polarizability: 66.1±0.5 10-24cm3
Surface Tension: 37.6±7.0 dyne/cm
Molar Volume: 522.0±7.0 cm3

Click to predict properties on the Chemicalize site


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