ChemSpider 2D Image | N-(2-{4-[6-(2,4-Dimethoxyphenyl)-3-pyridazinyl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-phenyl-N-(1-phenylethyl)acetamide | C35H39N5O4

N-(2-{4-[6-(2,4-Dimethoxyphenyl)-3-pyridazinyl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-phenyl-N-(1-phenylethyl)acetamide

  • Molecular FormulaC35H39N5O4
  • Average mass593.715 Da
  • Monoisotopic mass593.300232 Da
  • ChemSpider ID22677274

More details:

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

Benzeneacetamide, N-[2-[4-[6-(2,4-dimethoxyphenyl)-3-pyridazinyl]hexahydro-1H-1,4-diazepin-1-yl]-2-oxoethyl]-N-(1-phenylethyl)- [ACD/Index Name]
N-(2-{4-[6-(2,4-Dimethoxyphenyl)-3-pyridazinyl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-phenyl-N-(1-phenylethyl)acetamid [German] [ACD/IUPAC Name]
N-(2-{4-[6-(2,4-Dimethoxyphenyl)-3-pyridazinyl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-phenyl-N-(1-phenylethyl)acetamide [ACD/IUPAC Name]
N-(2-{4-[6-(2,4-Diméthoxyphényl)-3-pyridazinyl]-1,4-diazépan-1-yl}-2-oxoéthyl)-2-phényl-N-(1-phényléthyl)acétamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 817.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 118.8±3.0 kJ/mol
Flash Point: 448.1±34.3 °C
Index of Refraction: 1.601
Molar Refractivity: 169.2±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 3.92
ACD/LogD (pH 5.5): 3.94
ACD/BCF (pH 5.5): 513.65
ACD/KOC (pH 5.5): 2607.19
ACD/LogD (pH 7.4): 4.17
ACD/BCF (pH 7.4): 867.15
ACD/KOC (pH 7.4): 4401.47
Polar Surface Area: 88 Å2
Polarizability: 67.1±0.5 10-24cm3
Surface Tension: 52.6±3.0 dyne/cm
Molar Volume: 494.0±3.0 cm3

Click to predict properties on the Chemicalize site


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