ChemSpider 2D Image | 2-[5-Cyclohexyl-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-1,2-dihydro-3H-1,3,4-benzotriazepin-3-yl]-N-{3-[(2-ethoxyethyl)amino]phenyl}acetamide | C32H43N5O4

2-[5-Cyclohexyl-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-1,2-dihydro-3H-1,3,4-benzotriazepin-3-yl]-N-{3-[(2-ethoxyethyl)amino]phenyl}acetamide

  • Molecular FormulaC32H43N5O4
  • Average mass561.715 Da
  • Monoisotopic mass561.331482 Da
  • ChemSpider ID9766924

More details:

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

2-[5-Cyclohexyl-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-1,2-dihydro-3H-1,3,4-benzotriazepin-3-yl]-N-{3-[(2-ethoxyethyl)amino]phenyl}acetamid [German] [ACD/IUPAC Name]
2-[5-Cyclohexyl-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-1,2-dihydro-3H-1,3,4-benzotriazepin-3-yl]-N-{3-[(2-ethoxyethyl)amino]phenyl}acetamide [ACD/IUPAC Name]
2-[5-Cyclohexyl-1-(3,3-diméthyl-2-oxobutyl)-2-oxo-1,2-dihydro-3H-1,3,4-benzotriazépin-3-yl]-N-{3-[(2-éthoxyéthyl)amino]phényl}acétamide [French] [ACD/IUPAC Name]
3H-1,3,4-Benzotriazepine-3-acetamide, 5-cyclohexyl-1-(3,3-dimethyl-2-oxobutyl)-N-[3-[(2-ethoxyethyl)amino]phenyl]-1,2-dihydro-2-oxo- [ACD/Index Name]
2-(5-cyclohexyl-1-(3,3-dimethyl-2-oxo-butyl)-2-oxo-1,2-dihydro-3H-1,3,4-benzotriazepin-3-yl)-N-(3-(2-ethoxy-ethylamino)-phenyl)-acetamide

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.601
Molar Refractivity: 160.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 3.56
ACD/LogD (pH 5.5): 3.77
ACD/BCF (pH 5.5): 423.95
ACD/KOC (pH 5.5): 2582.02
ACD/LogD (pH 7.4): 3.81
ACD/BCF (pH 7.4): 460.24
ACD/KOC (pH 7.4): 2803.07
Polar Surface Area: 103 Å2
Polarizability: 63.7±0.5 10-24cm3
Surface Tension: 45.8±7.0 dyne/cm
Molar Volume: 468.7±7.0 cm3

Click to predict properties on the Chemicalize site


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