ChemSpider 2D Image | 7-(Difluoromethyl)-N'-[(Z)-{2-[(2-furylmethyl)sulfanyl]-5-nitrophenyl}methylene]-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbohydrazide | C26H22F2N6O4S

7-(Difluoromethyl)-N'-[(Z)-{2-[(2-furylmethyl)sulfanyl]-5-nitrophenyl}methylene]-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbohydrazide

  • Molecular FormulaC26H22F2N6O4S
  • Average mass552.552 Da
  • Monoisotopic mass552.139160 Da
  • ChemSpider ID82122631

  • Double-bond stereo - Double-bond stereo

More details:

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

7-(Difluormethyl)-N'-[(Z)-{2-[(2-furylmethyl)sulfanyl]-5-nitrophenyl}methylen]-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-carbohydrazid [German] [ACD/IUPAC Name]
7-(Difluoromethyl)-N'-[(Z)-{2-[(2-furylmethyl)sulfanyl]-5-nitrophenyl}methylene]-5-phenyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carbohydrazide [ACD/IUPAC Name]
7-(Difluorométhyl)-N'-[(Z)-{2-[(2-furylméthyl)sulfanyl]-5-nitrophényl}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)-[2-[(2-furanylmethyl)thio]-5-nitrophenyl]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: 1.696
Molar Refractivity: 141.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 4.77
ACD/LogD (pH 5.5): 4.82
ACD/BCF (pH 5.5): 2688.20
ACD/KOC (pH 5.5): 9917.40
ACD/LogD (pH 7.4): 4.82
ACD/BCF (pH 7.4): 2688.17
ACD/KOC (pH 7.4): 9917.29
Polar Surface Area: 156 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 59.1±7.0 dyne/cm
Molar Volume: 366.9±7.0 cm3

Click to predict properties on the Chemicalize site


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