ChemSpider 2D Image | N-{2-[(4-Chlorophenyl)amino]-2-oxoethyl}-6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]-1,4-dihydro-3-pyridazinecarboxamide | C21H16ClF3N4O3

N-{2-[(4-Chlorophenyl)amino]-2-oxoethyl}-6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]-1,4-dihydro-3-pyridazinecarboxamide

  • Molecular FormulaC21H16ClF3N4O3
  • Average mass464.825 Da
  • Monoisotopic mass464.086304 Da
  • ChemSpider ID30068032

More details:

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

3-Pyridazinecarboxamide, N-[2-[(4-chlorophenyl)amino]-2-oxoethyl]-1,4-dihydro-6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]- [ACD/Index Name]
N-{2-[(4-Chlorophenyl)amino]-2-oxoethyl}-6-methyl-4-oxo-1-[2-(trifluoromethyl)phenyl]-1,4-dihydro-3-pyridazinecarboxamide [ACD/IUPAC Name]
N-{2-[(4-Chlorophényl)amino]-2-oxoéthyl}-6-méthyl-4-oxo-1-[2-(trifluorométhyl)phényl]-1,4-dihydro-3-pyridazinecarboxamide [French] [ACD/IUPAC Name]
N-{2-[(4-Chlorphenyl)amino]-2-oxoethyl}-6-methyl-4-oxo-1-[2-(trifluormethyl)phenyl]-1,4-dihydro-3-pyridazincarboxamid [German] [ACD/IUPAC Name]
N-(4-CHLOROPHENYL)-2-({6-METHYL-4-OXO-1-[2-(TRIFLUOROMETHYL)PHENYL]PYRIDAZIN-3-YL}FORMAMIDO)ACETAMIDE

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.607
Molar Refractivity: 111.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.32
ACD/LogD (pH 5.5): 2.92
ACD/BCF (pH 5.5): 96.77
ACD/KOC (pH 5.5): 917.73
ACD/LogD (pH 7.4): 2.84
ACD/BCF (pH 7.4): 81.47
ACD/KOC (pH 7.4): 772.57
Polar Surface Area: 91 Å2
Polarizability: 44.4±0.5 10-24cm3
Surface Tension: 46.9±7.0 dyne/cm
Molar Volume: 324.1±7.0 cm3

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