ChemSpider 2D Image | N'-[(Z)-{2-[(2,5-Difluorobenzyl)oxy]-4-fluorophenyl}methylene]-5-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbohydrazide | C29H23F6N5O3

N'-[(Z)-{2-[(2,5-Difluorobenzyl)oxy]-4-fluorophenyl}methylene]-5-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbohydrazide

  • Molecular FormulaC29H23F6N5O3
  • Average mass603.515 Da
  • Monoisotopic mass603.170532 Da
  • ChemSpider ID81858925

  • Double-bond stereo - Double-bond stereo

More details:

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

N'-[(Z)-{2-[(2,5-Difluorbenzyl)oxy]-4-fluorphenyl}methylen]-5-(4-methoxyphenyl)-7-(trifluormethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-carbohydrazid [German] [ACD/IUPAC Name]
N'-[(Z)-{2-[(2,5-Difluorobenzyl)oxy]-4-fluorophenyl}methylene]-5-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbohydrazide [ACD/IUPAC Name]
N'-[(Z)-{2-[(2,5-Difluorobenzyl)oxy]-4-fluorophényl}méthylène]-5-(4-méthoxyphényl)-7-(trifluorométhyl)-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)-[2-[(2,5-difluorophenyl)methoxy]-4-fluorophenyl]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: 6.02
ACD/LogD (pH 5.5): 5.49
ACD/BCF (pH 5.5): 8788.97
ACD/KOC (pH 5.5): 23155.67
ACD/LogD (pH 7.4): 5.49
ACD/BCF (pH 7.4): 8788.61
ACD/KOC (pH 7.4): 23154.73
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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