ChemSpider 2D Image | 7-(Difluoromethyl)-N'-{(Z)-[4-(hexyloxy)phenyl]methylene}-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbohydrazide | C27H31F2N5O2

7-(Difluoromethyl)-N'-{(Z)-[4-(hexyloxy)phenyl]methylene}-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbohydrazide

  • Molecular FormulaC27H31F2N5O2
  • Average mass495.564 Da
  • Monoisotopic mass495.244568 Da
  • ChemSpider ID82121008

  • Double-bond stereo - Double-bond stereo

More details:

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

7-(Difluormethyl)-N'-{(Z)-[4-(hexyloxy)phenyl]methylen}-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-carbohydrazid [German] [ACD/IUPAC Name]
7-(Difluoromethyl)-N'-{(Z)-[4-(hexyloxy)phenyl]methylene}-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbohydrazide [ACD/IUPAC Name]
7-(Difluorométhyl)-N'-{(Z)-[4-(hexyloxy)phényl]méthylène}-5-phényl-4,5,6,7-tétrahydropyrazolo[1,5-a]pyrimidine-3-carbohydrazide [French] [ACD/IUPAC Name]
Pyrazolo[1,5-a]pyrimidine-3-carboxylic acid, 7-(difluoromethyl)-4,5,6,7-tetrahydro-5-phenyl-, 2-[(1Z)-[4-(hexyloxy)phenyl]methylene]hydrazide [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.606
Molar Refractivity: 134.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 6.20
ACD/LogD (pH 5.5): 5.99
ACD/BCF (pH 5.5): 21158.77
ACD/KOC (pH 5.5): 43427.56
ACD/LogD (pH 7.4): 5.99
ACD/BCF (pH 7.4): 21159.45
ACD/KOC (pH 7.4): 43428.94
Polar Surface Area: 81 Å2
Polarizability: 53.4±0.5 10-24cm3
Surface Tension: 44.3±7.0 dyne/cm
Molar Volume: 391.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement