ChemSpider 2D Image | 2-(1H-Benzotriazol-1-yl)-N-{1-(3,5-dimethoxyphenyl)-2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-N-phenylacetamide | C28H31N5O4

2-(1H-Benzotriazol-1-yl)-N-{1-(3,5-dimethoxyphenyl)-2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-N-phenylacetamide

  • Molecular FormulaC28H31N5O4
  • Average mass501.577 Da
  • Monoisotopic mass501.237610 Da
  • ChemSpider ID2449204

More details:

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

1H-1,2,3-Benzotriazole-1-acetamide, N-[1-(3,5-dimethoxyphenyl)-2-[(1,1-dimethylethyl)amino]-2-oxoethyl]-N-phenyl- [ACD/Index Name]
2-(1H-Benzotriazol-1-yl)-N-{1-(3,5-dimethoxyphenyl)-2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-N-phenylacetamid [German] [ACD/IUPAC Name]
2-(1H-Benzotriazol-1-yl)-N-{1-(3,5-dimethoxyphenyl)-2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-N-phenylacetamide [ACD/IUPAC Name]
2-(1H-Benzotriazol-1-yl)-N-{1-(3,5-diméthoxyphényl)-2-[(2-méthyl-2-propanyl)amino]-2-oxoéthyl}-N-phénylacétamide [French] [ACD/IUPAC Name]

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

ASN 05294807 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 731.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.8±3.0 kJ/mol
Flash Point: 396.4±32.9 °C
Index of Refraction: 1.607
Molar Refractivity: 142.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.84
ACD/LogD (pH 5.5): 3.78
ACD/BCF (pH 5.5): 441.99
ACD/KOC (pH 5.5): 2723.86
ACD/LogD (pH 7.4): 3.78
ACD/BCF (pH 7.4): 442.01
ACD/KOC (pH 7.4): 2723.98
Polar Surface Area: 99 Å2
Polarizability: 56.5±0.5 10-24cm3
Surface Tension: 45.2±7.0 dyne/cm
Molar Volume: 412.9±7.0 cm3

Click to predict properties on the Chemicalize site


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