ChemSpider 2D Image | N-[2-({4-[(3-Bromophenyl)amino]-6-(3-hydroxy-1-azetidinyl)-1,3,5-triazin-2-yl}amino)ethyl]acetamide | C16H20BrN7O2

N-[2-({4-[(3-Bromophenyl)amino]-6-(3-hydroxy-1-azetidinyl)-1,3,5-triazin-2-yl}amino)ethyl]acetamide

  • Molecular FormulaC16H20BrN7O2
  • Average mass422.280 Da
  • Monoisotopic mass421.086182 Da
  • ChemSpider ID124538199

More details:

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

Acetamide, N-[2-[[4-[(3-bromophenyl)amino]-6-(3-hydroxy-1-azetidinyl)-1,3,5-triazin-2-yl]amino]ethyl]- [ACD/Index Name]
N-[2-({4-[(3-Bromophenyl)amino]-6-(3-hydroxy-1-azetidinyl)-1,3,5-triazin-2-yl}amino)ethyl]acetamide [ACD/IUPAC Name]
N-[2-({4-[(3-Bromophényl)amino]-6-(3-hydroxy-1-azétidinyl)-1,3,5-triazin-2-yl}amino)éthyl]acétamide [French] [ACD/IUPAC Name]
N-[2-({4-[(3-Bromphenyl)amino]-6-(3-hydroxy-1-azetidinyl)-1,3,5-triazin-2-yl}amino)ethyl]acetamid [German] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.713
Molar Refractivity: 101.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -1.06
ACD/LogD (pH 5.5): 0.54
ACD/BCF (pH 5.5): 1.38
ACD/KOC (pH 5.5): 39.42
ACD/LogD (pH 7.4): 0.70
ACD/BCF (pH 7.4): 2.01
ACD/KOC (pH 7.4): 57.21
Polar Surface Area: 115 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 86.9±3.0 dyne/cm
Molar Volume: 260.0±3.0 cm3

Click to predict properties on the Chemicalize site


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