ChemSpider 2D Image | 2-[4-(2-Methoxyphenyl)-1-piperazinyl]-5-{[4-(2-methyl-2-propanyl)benzoyl]amino}-N-[3-(4-morpholinyl)propyl]benzamide | C36H47N5O4

2-[4-(2-Methoxyphenyl)-1-piperazinyl]-5-{[4-(2-methyl-2-propanyl)benzoyl]amino}-N-[3-(4-morpholinyl)propyl]benzamide

  • Molecular FormulaC36H47N5O4
  • Average mass613.789 Da
  • Monoisotopic mass613.362793 Da
  • ChemSpider ID3776859

More details:

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

2-[4-(2-Methoxyphenyl)-1-piperazinyl]-5-{[4-(2-methyl-2-propanyl)benzoyl]amino}-N-[3-(4-morpholinyl)propyl]benzamid [German] [ACD/IUPAC Name]
2-[4-(2-Methoxyphenyl)-1-piperazinyl]-5-{[4-(2-methyl-2-propanyl)benzoyl]amino}-N-[3-(4-morpholinyl)propyl]benzamide [ACD/IUPAC Name]
2-[4-(2-Méthoxyphényl)-1-pipérazinyl]-5-{[4-(2-méthyl-2-propanyl)benzoyl]amino}-N-[3-(4-morpholinyl)propyl]benzamide [French] [ACD/IUPAC Name]
Benzamide, 5-[[4-(1,1-dimethylethyl)benzoyl]amino]-2-[4-(2-methoxyphenyl)-1-piperazinyl]-N-[3-(4-morpholinyl)propyl]- [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: 726.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.1±3.0 kJ/mol
Flash Point: 393.4±32.9 °C
Index of Refraction: 1.597
Molar Refractivity: 178.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 4.42
ACD/LogD (pH 5.5): 1.78
ACD/BCF (pH 5.5): 3.30
ACD/KOC (pH 5.5): 15.76
ACD/LogD (pH 7.4): 4.06
ACD/BCF (pH 7.4): 635.89
ACD/KOC (pH 7.4): 3038.14
Polar Surface Area: 86 Å2
Polarizability: 70.8±0.5 10-24cm3
Surface Tension: 49.2±3.0 dyne/cm
Molar Volume: 524.5±3.0 cm3

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