ChemSpider 2D Image | 5-(4-Methoxyphenyl)-7-(trifluoromethyl)-N'-[(Z)-{3-[(2,3,4-trifluorophenoxy)methyl]phenyl}methylene]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbohydrazide | C29H23F6N5O3

5-(4-Methoxyphenyl)-7-(trifluoromethyl)-N'-[(Z)-{3-[(2,3,4-trifluorophenoxy)methyl]phenyl}methylene]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbohydrazide

  • Molecular FormulaC29H23F6N5O3
  • Average mass603.515 Da
  • Monoisotopic mass603.170532 Da
  • ChemSpider ID81858919

  • Double-bond stereo - Double-bond stereo

More details:

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

5-(4-Methoxyphenyl)-7-(trifluormethyl)-N'-[(Z)-{3-[(2,3,4-trifluorphenoxy)methyl]phenyl}methylen]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-carbohydrazid [German] [ACD/IUPAC Name]
5-(4-Methoxyphenyl)-7-(trifluoromethyl)-N'-[(Z)-{3-[(2,3,4-trifluorophenoxy)methyl]phenyl}methylene]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbohydrazide [ACD/IUPAC Name]
5-(4-Méthoxyphényl)-7-(trifluorométhyl)-N'-[(Z)-{3-[(2,3,4-trifluorophénoxy)méthyl]phényl}méthylène]-4,5,6,7-tétrahydropyrazolo[1,5-a]pyrimidine-3-carbohydrazide [French] [ACD/IUPAC Name]
Pyrazolo[1,5-a]pyrimidine-3-carboxylic acid, 4,5,6,7-tetrahydro-5-(4-methoxyphenyl)-7-(trifluoromethyl)-, 2-[(1Z)-[3-[(2,3,4-trifluorophenoxy)methyl]phenyl]methylene]hydrazide [ACD/Index Name]

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: 1.600
Molar Refractivity: 142.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.86
ACD/LogD (pH 5.5): 5.66
ACD/BCF (pH 5.5): 11815.68
ACD/KOC (pH 5.5): 28618.75
ACD/LogD (pH 7.4): 5.66
ACD/BCF (pH 7.4): 11815.86
ACD/KOC (pH 7.4): 28619.20
Polar Surface Area: 90 Å2
Polarizability: 56.6±0.5 10-24cm3
Surface Tension: 42.4±7.0 dyne/cm
Molar Volume: 417.7±7.0 cm3

Click to predict properties on the Chemicalize site


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