ChemSpider 2D Image | N-[2-(sec-Butyl{[1-(3-methoxybenzyl)-1H-pyrrol-2-yl]methyl}amino)-2-oxoethyl]-2,4-dimethoxy-N-(3-methoxypropyl)benzamide | C32H43N3O6

N-[2-(sec-Butyl{[1-(3-methoxybenzyl)-1H-pyrrol-2-yl]methyl}amino)-2-oxoethyl]-2,4-dimethoxy-N-(3-methoxypropyl)benzamide

  • Molecular FormulaC32H43N3O6
  • Average mass565.700 Da
  • Monoisotopic mass565.315186 Da
  • ChemSpider ID4388640

More details:

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

Benzamide, 2,4-dimethoxy-N-[2-[[[1-[(3-methoxyphenyl)methyl]-1H-pyrrol-2-yl]methyl](1-methylpropyl)amino]-2-oxoethyl]-N-(3-methoxypropyl)- [ACD/Index Name]
N-[2-(sec-Butyl{[1-(3-methoxybenzyl)-1H-pyrrol-2-yl]methyl}amino)-2-oxoethyl]-2,4-dimethoxy-N-(3-methoxypropyl)benzamid [German] [ACD/IUPAC Name]
N-[2-(sec-Butyl{[1-(3-methoxybenzyl)-1H-pyrrol-2-yl]methyl}amino)-2-oxoethyl]-2,4-dimethoxy-N-(3-methoxypropyl)benzamide [ACD/IUPAC Name]
N-[2-(sec-Butyl{[1-(3-méthoxybenzyl)-1H-pyrrol-2-yl]méthyl}amino)-2-oxoéthyl]-2,4-diméthoxy-N-(3-méthoxypropyl)benzamide [French] [ACD/IUPAC 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: 733.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.1±3.0 kJ/mol
Flash Point: 397.6±32.9 °C
Index of Refraction: 1.543
Molar Refractivity: 160.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 4.28
ACD/LogD (pH 5.5): 4.44
ACD/BCF (pH 5.5): 1384.07
ACD/KOC (pH 5.5): 6166.50
ACD/LogD (pH 7.4): 4.44
ACD/BCF (pH 7.4): 1384.07
ACD/KOC (pH 7.4): 6166.51
Polar Surface Area: 82 Å2
Polarizability: 63.6±0.5 10-24cm3
Surface Tension: 38.9±7.0 dyne/cm
Molar Volume: 509.0±7.0 cm3

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