ChemSpider 2D Image | 2-(2-{[2-(4-Hydroxy-3-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]carbonothioyl}hydrazino)-N-(2-methyl-4-oxo-3(4H)-quinazolinyl)acetamide | C22H22N6O5S2

2-(2-{[2-(4-Hydroxy-3-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]carbonothioyl}hydrazino)-N-(2-methyl-4-oxo-3(4H)-quinazolinyl)acetamide

  • Molecular FormulaC22H22N6O5S2
  • Average mass514.577 Da
  • Monoisotopic mass514.109314 Da
  • ChemSpider ID9170052

More details:

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

2-(2-{[2-(4-Hydroxy-3-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]carbonothioyl}hydrazino)-N-(2-methyl-4-oxo-3(4H)-chinazolinyl)acetamid [German] [ACD/IUPAC Name]
2-(2-{[2-(4-Hydroxy-3-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]carbonothioyl}hydrazino)-N-(2-methyl-4-oxo-3(4H)-quinazolinyl)acetamide [ACD/IUPAC Name]
2-(2-{[2-(4-Hydroxy-3-méthoxyphényl)-4-oxo-1,3-thiazolidin-3-yl]carbonothioyl}hydrazino)-N-(2-méthyl-4-oxo-3(4H)-quinazolinyl)acétamide [French] [ACD/IUPAC Name]
3-Thiazolidinecarbothioic acid, 2-(4-hydroxy-3-methoxyphenyl)-4-oxo-, 2-[2-[(2-methyl-4-oxo-3(4H)-quinazolinyl)amino]-2-oxoethyl]hydrazide [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.743
Molar Refractivity: 133.4±0.5 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -0.65
ACD/LogD (pH 5.5): -0.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 21.80
ACD/LogD (pH 7.4): -0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 21.06
Polar Surface Area: 193 Å2
Polarizability: 52.9±0.5 10-24cm3
Surface Tension: 65.2±7.0 dyne/cm
Molar Volume: 329.7±7.0 cm3

Click to predict properties on the Chemicalize site


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