ChemSpider 2D Image | 2-(1H-Benzotriazol-1-yl)-N-cyclohexyl-N-{2-oxo-2-[(tetrahydro-2-furanylmethyl)amino]-1-(3,4,5-trimethoxyphenyl)ethyl}acetamide | C30H39N5O6

2-(1H-Benzotriazol-1-yl)-N-cyclohexyl-N-{2-oxo-2-[(tetrahydro-2-furanylmethyl)amino]-1-(3,4,5-trimethoxyphenyl)ethyl}acetamide

  • Molecular FormulaC30H39N5O6
  • Average mass565.661 Da
  • Monoisotopic mass565.290039 Da
  • ChemSpider ID2442608

More details:

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

1H-1,2,3-Benzotriazole-1-acetamide, N-cyclohexyl-N-[2-oxo-2-[[(tetrahydro-2-furanyl)methyl]amino]-1-(3,4,5-trimethoxyphenyl)ethyl]- [ACD/Index Name]
2-(1H-Benzotriazol-1-yl)-N-cyclohexyl-N-{2-oxo-2-[(tetrahydro-2-furanylmethyl)amino]-1-(3,4,5-trimethoxyphenyl)ethyl}acetamid [German] [ACD/IUPAC Name]
2-(1H-Benzotriazol-1-yl)-N-cyclohexyl-N-{2-oxo-2-[(tetrahydro-2-furanylmethyl)amino]-1-(3,4,5-trimethoxyphenyl)ethyl}acetamide [ACD/IUPAC Name]
2-(1H-Benzotriazol-1-yl)-N-cyclohexyl-N-{2-oxo-2-[(tétrahydro-2-furanylméthyl)amino]-1-(3,4,5-triméthoxyphényl)éthyl}acétamide [French] [ACD/IUPAC Name]

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

ASN 04884882 [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: 800.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 116.4±3.0 kJ/mol
Flash Point: 438.0±34.3 °C
Index of Refraction: 1.632
Molar Refractivity: 151.8±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 3.17
ACD/LogD (pH 5.5): 2.79
ACD/BCF (pH 5.5): 77.57
ACD/KOC (pH 5.5): 783.87
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 77.57
ACD/KOC (pH 7.4): 783.90
Polar Surface Area: 117 Å2
Polarizability: 60.2±0.5 10-24cm3
Surface Tension: 49.9±7.0 dyne/cm
Molar Volume: 425.7±7.0 cm3

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