ChemSpider 2D Image | 2-(3,4-Dihydroxyphenyl)-N-(2-furylmethyl)-N-[2-({[(4-methylphenyl)sulfonyl]methyl}amino)-1-(2-naphthyl)-2-oxoethyl]acetamide | C33H30N2O7S

2-(3,4-Dihydroxyphenyl)-N-(2-furylmethyl)-N-[2-({[(4-methylphenyl)sulfonyl]methyl}amino)-1-(2-naphthyl)-2-oxoethyl]acetamide

  • Molecular FormulaC33H30N2O7S
  • Average mass598.666 Da
  • Monoisotopic mass598.177368 Da
  • ChemSpider ID21106054

More details:

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

2-(3,4-Dihydroxyphenyl)-N-(2-furylmethyl)-N-[2-({[(4-methylphenyl)sulfonyl]methyl}amino)-1-(2-naphthyl)-2-oxoethyl]acetamid [German] [ACD/IUPAC Name]
2-(3,4-Dihydroxyphenyl)-N-(2-furylmethyl)-N-[2-({[(4-methylphenyl)sulfonyl]methyl}amino)-1-(2-naphthyl)-2-oxoethyl]acetamide [ACD/IUPAC Name]
2-(3,4-Dihydroxyphényl)-N-(2-furylméthyl)-N-[2-({[(4-méthylphényl)sulfonyl]méthyl}amino)-1-(2-naphtyl)-2-oxoéthyl]acétamide [French] [ACD/IUPAC Name]
2-(3,4-dihydroxyphenyl)-N-(furan-2-ylmethyl)-N-[2-({[(4-methylphenyl)sulfonyl]methyl}amino)-1-(naphthalen-2-yl)-2-oxoethyl]acetamide
2-Naphthaleneacetamide, α-[[2-(3,4-dihydroxyphenyl)acetyl](2-furanylmethyl)amino]-N-[[(4-methylphenyl)sulfonyl]methyl]- [ACD/Index 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: 928.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 139.6±3.0 kJ/mol
Flash Point: 515.1±34.3 °C
Index of Refraction: 1.669
Molar Refractivity: 163.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.46
ACD/LogD (pH 5.5): 3.44
ACD/BCF (pH 5.5): 242.53
ACD/KOC (pH 5.5): 1772.56
ACD/LogD (pH 7.4): 3.43
ACD/BCF (pH 7.4): 239.53
ACD/KOC (pH 7.4): 1750.64
Polar Surface Area: 146 Å2
Polarizability: 64.6±0.5 10-24cm3
Surface Tension: 64.2±3.0 dyne/cm
Molar Volume: 437.0±3.0 cm3

Click to predict properties on the Chemicalize site


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