Found 411 results

Search term: MF = 'C_{21}H_{18}BrN_{5}O_{2}'
ChemSpider 2D Image | N-(4-Bromophenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide | C21H18BrN5O2

N-(4-Bromophenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide

  • Molecular FormulaC21H18BrN5O2
  • Average mass452.304 Da
  • Monoisotopic mass451.064392 Da
  • ChemSpider ID26316454

More details:

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

1,2,4-Triazolo[4,3-b]pyridazine-2(3H)-acetamide, N-(4-bromophenyl)-6-(3,4-dimethylphenyl)-3-oxo- [ACD/Index Name]
N-(4-Bromophenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide [ACD/IUPAC Name]
N-(4-Bromophényl)-2-[6-(3,4-diméthylphényl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acétamide [French] [ACD/IUPAC Name]
N-(4-Bromphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamid [German] [ACD/IUPAC Name]
1185160-90-0 [RN]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL4519404/
N-(4-bromophenyl)-2-(6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl)acetamide
N-(4-bromophenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo-[1,2,4]triazolo[4,3-b]pyridazin-2-yl]acetamide
N-(4-bromophenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo-2H,3H-[1,2,4]triazolo[4,3-b]pyridazin-2-yl]acetamide
N-cyclopropyl-4-{[1-(2-furoyl)piperidin-4-yl]methoxy}benzamide

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: 1.701
Molar Refractivity: 115.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.00
ACD/LogD (pH 5.5): 3.26
ACD/BCF (pH 5.5): 175.22
ACD/KOC (pH 5.5): 1404.63
ACD/LogD (pH 7.4): 3.26
ACD/BCF (pH 7.4): 175.22
ACD/KOC (pH 7.4): 1404.63
Polar Surface Area: 77 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 55.9±7.0 dyne/cm
Molar Volume: 297.5±7.0 cm3

Click to predict properties on the Chemicalize site


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