ChemSpider 2D Image | N-{2-Oxo-2-[4-(6-phenyl-3-pyridazinyl)-1,4-diazepan-1-yl]ethyl}-2-phenyl-N-(1-phenylethyl)acetamide | C33H35N5O2

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

  • Molecular FormulaC33H35N5O2
  • Average mass533.663 Da
  • Monoisotopic mass533.279053 Da
  • ChemSpider ID22678736

More details:

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

Benzeneacetamide, N-[2-[hexahydro-4-(6-phenyl-3-pyridazinyl)-1H-1,4-diazepin-1-yl]-2-oxoethyl]-N-(1-phenylethyl)- [ACD/Index Name]
N-{2-Oxo-2-[4-(6-phenyl-3-pyridazinyl)-1,4-diazepan-1-yl]ethyl}-2-phenyl-N-(1-phenylethyl)acetamid [German] [ACD/IUPAC Name]
N-{2-Oxo-2-[4-(6-phenyl-3-pyridazinyl)-1,4-diazepan-1-yl]ethyl}-2-phenyl-N-(1-phenylethyl)acetamide [ACD/IUPAC Name]
N-{2-Oxo-2-[4-(6-phényl-3-pyridazinyl)-1,4-diazépan-1-yl]éthyl}-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: 798.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 116.1±3.0 kJ/mol
Flash Point: 436.7±32.9 °C
Index of Refraction: 1.616
Molar Refractivity: 155.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.56
ACD/LogD (pH 5.5): 4.62
ACD/BCF (pH 5.5): 1589.48
ACD/KOC (pH 5.5): 5456.24
ACD/LogD (pH 7.4): 4.95
ACD/BCF (pH 7.4): 3413.34
ACD/KOC (pH 7.4): 11717.04
Polar Surface Area: 70 Å2
Polarizability: 61.8±0.5 10-24cm3
Surface Tension: 54.7±3.0 dyne/cm
Molar Volume: 446.0±3.0 cm3

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