ChemSpider 2D Image | N-(2-{4-[6-(2,4-Dimethoxyphenyl)-3-pyridazinyl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-methoxy-N-(1-phenylethyl)acetamide | C30H37N5O5

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

  • Molecular FormulaC30H37N5O5
  • Average mass547.645 Da
  • Monoisotopic mass547.279480 Da
  • ChemSpider ID22677518

More details:

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

Acetamide, N-[2-[4-[6-(2,4-dimethoxyphenyl)-3-pyridazinyl]hexahydro-1H-1,4-diazepin-1-yl]-2-oxoethyl]-2-methoxy-N-(1-phenylethyl)- [ACD/Index Name]
N-(2-{4-[6-(2,4-Dimethoxyphenyl)-3-pyridazinyl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-methoxy-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-methoxy-N-(1-phenylethyl)acetamide [ACD/IUPAC Name]
N-(2-{4-[6-(2,4-Diméthoxyphényl)-3-pyridazinyl]-1,4-diazépan-1-yl}-2-oxoéthyl)-2-méthoxy-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: 761.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 110.8±3.0 kJ/mol
Flash Point: 414.1±32.9 °C
Index of Refraction: 1.577
Molar Refractivity: 151.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 2.24
ACD/LogD (pH 5.5): 2.65
ACD/BCF (pH 5.5): 54.03
ACD/KOC (pH 5.5): 520.17
ACD/LogD (pH 7.4): 2.88
ACD/BCF (pH 7.4): 91.17
ACD/KOC (pH 7.4): 877.75
Polar Surface Area: 97 Å2
Polarizability: 59.9±0.5 10-24cm3
Surface Tension: 50.6±3.0 dyne/cm
Molar Volume: 456.2±3.0 cm3

Click to predict properties on the Chemicalize site


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