ChemSpider 2D Image | 5-[(4-Fluorobenzyl)amino]-3,6-diphenyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one | C24H17FN4OS2

5-[(4-Fluorobenzyl)amino]-3,6-diphenyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one

  • Molecular FormulaC24H17FN4OS2
  • Average mass460.546 Da
  • Monoisotopic mass460.082794 Da
  • ChemSpider ID21128365

More details:

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

5-[(4-Fluorbenzyl)amino]-3,6-diphenyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-on [German] [ACD/IUPAC Name]
5-[(4-Fluorobenzyl)amino]-3,6-diphenyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one [ACD/IUPAC Name]
5-[(4-Fluorobenzyl)amino]-3,6-diphényl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one [French] [ACD/IUPAC Name]
Thiazolo[4,5-d]pyrimidin-7(6H)-one, 5-[[(4-fluorophenyl)methyl]amino]-2,3-dihydro-3,6-diphenyl-2-thioxo- [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: 582.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.0±3.0 kJ/mol
Flash Point: 305.8±32.9 °C
Index of Refraction: 1.718
Molar Refractivity: 130.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.16
ACD/LogD (pH 5.5): 3.97
ACD/BCF (pH 5.5): 615.42
ACD/KOC (pH 5.5): 3452.17
ACD/LogD (pH 7.4): 3.97
ACD/BCF (pH 7.4): 615.42
ACD/KOC (pH 7.4): 3452.17
Polar Surface Area: 105 Å2
Polarizability: 51.7±0.5 10-24cm3
Surface Tension: 54.8±7.0 dyne/cm
Molar Volume: 330.4±7.0 cm3

Click to predict properties on the Chemicalize site


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