ChemSpider 2D Image | (11'E)-17'-Chloro-14'-(4-chlorophenyl)-5'-phenyl-2'H,7'H-spiro[piperidine-4,8'-[15]thia[3,6,14]triazabicyclo[14.3.1]icosa[1(20),11,16,18]tetraene]-2',7'-dione 15',15'-dioxide | C32H34Cl2N4O4S

(11'E)-17'-Chloro-14'-(4-chlorophenyl)-5'-phenyl-2'H,7'H-spiro[piperidine-4,8'-[15]thia[3,6,14]triazabicyclo[14.3.1]icosa[1(20),11,16,18]tetraene]-2',7'-dione 15',15'-dioxide

  • Molecular FormulaC32H34Cl2N4O4S
  • Average mass641.608 Da
  • Monoisotopic mass640.167786 Da
  • ChemSpider ID103729126

  • Double-bond stereo - Double-bond stereo

More details:

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

(11'E)-17'-Chloro-14'-(4-chlorophenyl)-5'-phenyl-2'H,7'H-spiro[piperidine-4,8'-[15]thia[3,6,14]triazabicyclo[14.3.1]icosa[1(20),11,16,18]tetraene]-2',7'-dione 15',15'-dioxide [ACD/IUPAC Name]
Spiro[piperidine-4,9'-[2]thia[3,11,14]triazabicyclo[14.3.1]eicosa[1(20),5,16,18]tetraene]-10',15'-dione, 19'-chloro-3'-(4-chlorophenyl)-12'-phenyl-, 2',2'-dioxide, (5'E)- [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: 1.671
Molar Refractivity: 170.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 4.61
ACD/LogD (pH 5.5): 1.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.55
ACD/LogD (pH 7.4): 1.67
ACD/BCF (pH 7.4): 2.50
ACD/KOC (pH 7.4): 11.55
Polar Surface Area: 116 Å2
Polarizability: 67.5±0.5 10-24cm3
Surface Tension: 68.0±5.0 dyne/cm
Molar Volume: 455.8±5.0 cm3

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