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

N'-{(Z)-[3-(Benzyloxy)-4-hydroxyphenyl]methylene}-5-(4-fluorophenyl)-7-(pentafluoroethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carbohydrazide

  • Molecular FormulaC29H23F6N5O3
  • Average mass603.515 Da
  • Monoisotopic mass603.170532 Da
  • ChemSpider ID104665901

  • Double-bond stereo - Double-bond stereo

More details:

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

N'-{(Z)-[3-(Benzyloxy)-4-hydroxyphenyl]methylen}-5-(4-fluorphenyl)-7-(pentafluorethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-carbohydrazid [German] [ACD/IUPAC Name]
N'-{(Z)-[3-(Benzyloxy)-4-hydroxyphenyl]methylene}-5-(4-fluorophenyl)-7-(pentafluoroethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carbohydrazide [ACD/IUPAC Name]
N'-{(Z)-[3-(Benzyloxy)-4-hydroxyphényl]méthylène}-5-(4-fluorophényl)-7-(pentafluoroéthyl)-4,5,6,7-tétrahydropyrazolo[1,5-a]pyrimidine-2-carbohydrazide [French] [ACD/IUPAC Name]
Pyrazolo[1,5-a]pyrimidine-2-carboxylic acid, 5-(4-fluorophenyl)-4,5,6,7-tetrahydro-7-(1,1,2,2,2-pentafluoroethyl)-, 2-[(1Z)-[4-hydroxy-3-(phenylmethoxy)phenyl]methylene]hydrazide [ACD/Index Name]

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: 1.606
Molar Refractivity: 143.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 4.66
ACD/LogD (pH 5.5): 5.05
ACD/BCF (pH 5.5): 4087.84
ACD/KOC (pH 5.5): 13383.87
ACD/LogD (pH 7.4): 5.02
ACD/BCF (pH 7.4): 3805.66
ACD/KOC (pH 7.4): 12459.96
Polar Surface Area: 101 Å2
Polarizability: 56.7±0.5 10-24cm3
Surface Tension: 45.1±7.0 dyne/cm
Molar Volume: 414.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement