ChemSpider 2D Image | 5-Chloro-2-methoxy-N-(2-{3-[(methylcarbamothioyl)sulfamoyl]-4-(methylsulfinyl)phenyl}ethyl)benzamide | C19H22ClN3O5S3

5-Chloro-2-methoxy-N-(2-{3-[(methylcarbamothioyl)sulfamoyl]-4-(methylsulfinyl)phenyl}ethyl)benzamide

  • Molecular FormulaC19H22ClN3O5S3
  • Average mass504.043 Da
  • Monoisotopic mass503.041016 Da
  • ChemSpider ID8800677

More details:

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

5-Chlor-2-methoxy-N-(2-{3-[(methylcarbamothioyl)sulfamoyl]-4-(methylsulfinyl)phenyl}ethyl)benzamid [German] [ACD/IUPAC Name]
5-Chloro-2-methoxy-N-(2-{3-[(methylcarbamothioyl)sulfamoyl]-4-(methylsulfinyl)phenyl}ethyl)benzamide [ACD/IUPAC Name]
5-Chloro-2-méthoxy-N-(2-{3-[(méthylcarbamothioyl)sulfamoyl]-4-(méthylsulfinyl)phényl}éthyl)benzamide [French] [ACD/IUPAC Name]
Benzamide, 5-chloro-2-methoxy-N-[2-[3-[[[(methylamino)thioxomethyl]amino]sulfonyl]-4-(methylsulfinyl)phenyl]ethyl]- [ACD/Index Name]
5-[2-(5-chloro-2-methoxybenzamido)ethyl]-2-methoxythio-benzenesulfonyl-3-methlthiourea
benzamide, 5-chloro-N-[2-[3-[[[(1Z)-mercapto(methylamino)methylene]amino]sulfonyl]-4-(methylsulfinyl)phenyl]ethyl]-2-methoxy-
N'-{[5-{2-[(5-chloro-2-methoxybenzoyl)amino]ethyl}-2-(methylsulfinyl)phenyl]sulfonyl}-N-methylcarbamimidothioic acid

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: 1.680
Molar Refractivity: 126.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 0.58
ACD/LogD (pH 5.5): -0.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.85
ACD/LogD (pH 7.4): -0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.75
Polar Surface Area: 173 Å2
Polarizability: 50.1±0.5 10-24cm3
Surface Tension: 79.9±5.0 dyne/cm
Molar Volume: 334.3±5.0 cm3

Click to predict properties on the Chemicalize site


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