ChemSpider 2D Image | N-(2-Methoxyphenyl)-4-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-1,4-diazepane-1-carboxamide | C19H20F3N7O2

N-(2-Methoxyphenyl)-4-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-1,4-diazepane-1-carboxamide

  • Molecular FormulaC19H20F3N7O2
  • Average mass435.403 Da
  • Monoisotopic mass435.163055 Da
  • ChemSpider ID77451377

More details:

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

1H-1,4-Diazepine-1-carboxamide, hexahydro-N-(2-methoxyphenyl)-4-[3-(trifluoromethyl)-1,2,4-triazolo[4,3-b]pyridazin-6-yl]- [ACD/Index Name]
N-(2-Methoxyphenyl)-4-[3-(trifluormethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-1,4-diazepan-1-carboxamid [German] [ACD/IUPAC Name]
N-(2-Methoxyphenyl)-4-[3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-1,4-diazepane-1-carboxamide [ACD/IUPAC Name]
N-(2-Méthoxyphényl)-4-[3-(trifluorométhyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-1,4-diazépane-1-carboxamide [French] [ACD/IUPAC Name]
2380189-12-6 [RN]
N-(2-methoxyphenyl)-4-[3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-1,4-diazepane-1-carboxamide

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: 1.647
Molar Refractivity: 106.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.43
ACD/LogD (pH 5.5): 1.34
ACD/BCF (pH 5.5): 6.17
ACD/KOC (pH 5.5): 127.96
ACD/LogD (pH 7.4): 1.34
ACD/BCF (pH 7.4): 6.17
ACD/KOC (pH 7.4): 128.02
Polar Surface Area: 88 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 51.4±7.0 dyne/cm
Molar Volume: 292.4±7.0 cm3

Click to predict properties on the Chemicalize site


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