ChemSpider 2D Image | 2-(1H-Benzotriazol-1-yl)-N-(3,4-dimethoxyphenyl)-N-{2-[(3-methylbutyl)amino]-1-(5-methyl-2-furyl)-2-oxoethyl}acetamide | C28H33N5O5

2-(1H-Benzotriazol-1-yl)-N-(3,4-dimethoxyphenyl)-N-{2-[(3-methylbutyl)amino]-1-(5-methyl-2-furyl)-2-oxoethyl}acetamide

  • Molecular FormulaC28H33N5O5
  • Average mass519.592 Da
  • Monoisotopic mass519.248169 Da
  • ChemSpider ID2449784

More details:

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

1H-1,2,3-Benzotriazole-1-acetamide, N-(3,4-dimethoxyphenyl)-N-[2-[(3-methylbutyl)amino]-1-(5-methyl-2-furanyl)-2-oxoethyl]- [ACD/Index Name]
2-(1H-Benzotriazol-1-yl)-N-(3,4-dimethoxyphenyl)-N-{2-[(3-methylbutyl)amino]-1-(5-methyl-2-furyl)-2-oxoethyl}acetamid [German] [ACD/IUPAC Name]
2-(1H-Benzotriazol-1-yl)-N-(3,4-dimethoxyphenyl)-N-{2-[(3-methylbutyl)amino]-1-(5-methyl-2-furyl)-2-oxoethyl}acetamide [ACD/IUPAC Name]
2-(1H-Benzotriazol-1-yl)-N-(3,4-diméthoxyphényl)-N-{2-[(3-méthylbutyl)amino]-1-(5-méthyl-2-furyl)-2-oxoéthyl}acétamide [French] [ACD/IUPAC Name]

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

ASN 05296993 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 729.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.4±3.0 kJ/mol
Flash Point: 394.8±32.9 °C
Index of Refraction: 1.609
Molar Refractivity: 143.4±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 4.25
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 278.61
ACD/KOC (pH 5.5): 1957.62
ACD/LogD (pH 7.4): 3.52
ACD/BCF (pH 7.4): 278.62
ACD/KOC (pH 7.4): 1957.70
Polar Surface Area: 112 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 45.5±7.0 dyne/cm
Molar Volume: 414.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement