ChemSpider 2D Image | 3-Methoxy-N-(2-methoxyethyl)-N-(2-{4-[6-(4-methoxyphenyl)-3-pyridazinyl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide | C29H35N5O5

3-Methoxy-N-(2-methoxyethyl)-N-(2-{4-[6-(4-methoxyphenyl)-3-pyridazinyl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide

  • Molecular FormulaC29H35N5O5
  • Average mass533.619 Da
  • Monoisotopic mass533.263794 Da
  • ChemSpider ID22676274

More details:

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

3-Methoxy-N-(2-methoxyethyl)-N-(2-{4-[6-(4-methoxyphenyl)-3-pyridazinyl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamid [German] [ACD/IUPAC Name]
3-Methoxy-N-(2-methoxyethyl)-N-(2-{4-[6-(4-methoxyphenyl)-3-pyridazinyl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide [ACD/IUPAC Name]
3-Méthoxy-N-(2-méthoxyéthyl)-N-(2-{4-[6-(4-méthoxyphényl)-3-pyridazinyl]-1,4-diazépan-1-yl}-2-oxoéthyl)benzamide [French] [ACD/IUPAC Name]
Benzamide, N-[2-[hexahydro-4-[6-(4-methoxyphenyl)-3-pyridazinyl]-1H-1,4-diazepin-1-yl]-2-oxoethyl]-3-methoxy-N-(2-methoxyethyl)- [ACD/Index 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: 801.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 116.5±3.0 kJ/mol
Flash Point: 438.2±34.3 °C
Index of Refraction: 1.582
Molar Refractivity: 146.9±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 2.30
ACD/LogD (pH 5.5): 2.17
ACD/BCF (pH 5.5): 20.79
ACD/KOC (pH 5.5): 230.27
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 55.02
ACD/KOC (pH 7.4): 609.33
Polar Surface Area: 97 Å2
Polarizability: 58.3±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 440.5±3.0 cm3

Click to predict properties on the Chemicalize site


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