ChemSpider 2D Image | 2-[2-(4-Bromophenyl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]-N-(3,4-dimethoxybenzyl)acetamide | C22H20BrN5O4

2-[2-(4-Bromophenyl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]-N-(3,4-dimethoxybenzyl)acetamide

  • Molecular FormulaC22H20BrN5O4
  • Average mass498.329 Da
  • Monoisotopic mass497.069855 Da
  • ChemSpider ID27305226

More details:

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

2-[2-(4-Bromophenyl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]-N-(3,4-dimethoxybenzyl)acetamide [ACD/IUPAC Name]
2-[2-(4-Bromophényl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]-N-(3,4-diméthoxybenzyl)acétamide [French] [ACD/IUPAC Name]
2-[2-(4-Bromphenyl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5(4H)-yl]-N-(3,4-dimethoxybenzyl)acetamid [German] [ACD/IUPAC Name]
Pyrazolo[1,5-d][1,2,4]triazine-5(4H)-acetamide, 2-(4-bromophenyl)-N-[(3,4-dimethoxyphenyl)methyl]-4-oxo- [ACD/Index Name]
1326868-69-2 [RN]
2-[2-(4-bromophenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-[(3,4-dimethoxyphenyl)methyl]acetamide

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.674
Molar Refractivity: 122.5±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.87
ACD/LogD (pH 5.5): 2.48
ACD/BCF (pH 5.5): 45.18
ACD/KOC (pH 5.5): 532.39
ACD/LogD (pH 7.4): 2.48
ACD/BCF (pH 7.4): 45.18
ACD/KOC (pH 7.4): 532.39
Polar Surface Area: 98 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 55.3±7.0 dyne/cm
Molar Volume: 326.5±7.0 cm3

Click to predict properties on the Chemicalize site


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