ChemSpider 2D Image | 2-(1H-Benzotriazol-1-yl)-N-(4-methylbenzyl)-N-(2-{[4-(4-morpholinyl)phenyl]amino}-2-oxo-1-phenylethyl)acetamide | C34H34N6O3

2-(1H-Benzotriazol-1-yl)-N-(4-methylbenzyl)-N-(2-{[4-(4-morpholinyl)phenyl]amino}-2-oxo-1-phenylethyl)acetamide

  • Molecular FormulaC34H34N6O3
  • Average mass574.672 Da
  • Monoisotopic mass574.269226 Da
  • ChemSpider ID3507302

More details:

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

1H-1,2,3-Benzotriazole-1-acetamide, N-[(4-methylphenyl)methyl]-N-[2-[[4-(4-morpholinyl)phenyl]amino]-2-oxo-1-phenylethyl]- [ACD/Index Name]
2-(1H-Benzotriazol-1-yl)-N-(4-methylbenzyl)-N-(2-{[4-(4-morpholinyl)phenyl]amino}-2-oxo-1-phenylethyl)acetamid [German] [ACD/IUPAC Name]
2-(1H-Benzotriazol-1-yl)-N-(4-methylbenzyl)-N-(2-{[4-(4-morpholinyl)phenyl]amino}-2-oxo-1-phenylethyl)acetamide [ACD/IUPAC Name]
2-(1H-Benzotriazol-1-yl)-N-(4-méthylbenzyl)-N-(2-{[4-(4-morpholinyl)phényl]amino}-2-oxo-1-phényléthyl)acétamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 857.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 124.6±3.0 kJ/mol
Flash Point: 472.4±34.3 °C
Index of Refraction: 1.661
Molar Refractivity: 167.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.31
ACD/LogD (pH 5.5): 4.43
ACD/BCF (pH 5.5): 1090.19
ACD/KOC (pH 5.5): 3953.72
ACD/LogD (pH 7.4): 4.84
ACD/BCF (pH 7.4): 2797.87
ACD/KOC (pH 7.4): 10146.83
Polar Surface Area: 93 Å2
Polarizability: 66.6±0.5 10-24cm3
Surface Tension: 52.4±7.0 dyne/cm
Molar Volume: 454.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement