ChemSpider 2D Image | S-{2-[(2-Chloro-4-sulfamoylphenyl)amino]-2-oxoethyl} 6-methyl-3,4-dihydro-1(2H)-quinolinecarbothioate | C19H20ClN3O4S2

S-{2-[(2-Chloro-4-sulfamoylphenyl)amino]-2-oxoethyl} 6-methyl-3,4-dihydro-1(2H)-quinolinecarbothioate

  • Molecular FormulaC19H20ClN3O4S2
  • Average mass453.963 Da
  • Monoisotopic mass453.058380 Da
  • ChemSpider ID24656011

More details:

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

1(2H)-Quinolinecarbothioic acid, 3,4-dihydro-6-methyl-, S-[2-[[4-(aminosulfonyl)-2-chlorophenyl]amino]-2-oxoethyl] ester [ACD/Index Name]
6-Méthyl-3,4-dihydro-1(2H)-quinoléinecarbothioate de S-{2-[(2-chloro-4-sulfamoylphényl)amino]-2-oxoéthyle} [French] [ACD/IUPAC Name]
960310-09-2 [RN]
S-[2-[[4-(Aminosulfonyl)-2-chlorophenyl]amino]-2-oxoethyl] 3,4-dihydro-6-methyl-1(2H)-quinolinecarbothioate
S-{2-[(2-Chlor-4-sulfamoylphenyl)amino]-2-oxoethyl}-6-methyl-3,4-dihydro-1(2H)-chinolincarbothioat [German] [ACD/IUPAC Name]
S-{2-[(2-Chloro-4-sulfamoylphenyl)amino]-2-oxoethyl} 6-methyl-3,4-dihydro-1(2H)-quinolinecarbothioate [ACD/IUPAC Name]
S-{2-[(2-chloro-4-sulfamoylphenyl)amino]-2-oxoethyl} 6-methyl-3,4-dihydroquinoline-1(2H)-carbothioate
N-(2-chloro-4-sulfamoylphenyl)-2-(6-methyl-1,2,3,4-tetrahydroquinoline-1-carbonylsulfanyl)acetamide
N-(2-chloro-4-sulfamoylphenyl)-2-(6-methyl-3,4-dihydro-2H-quinoline-1-carbonylsulfanyl)acetamide
N-(2-chloro-4-sulfamoylphenyl)-2-[(6-methyl-1,2,3,4-tetrahydroquinolin-1-yl)carbonylsulfanyl]acetamide

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: 1.671
Molar Refractivity: 114.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.49
ACD/LogD (pH 5.5): 2.81
ACD/BCF (pH 5.5): 80.51
ACD/KOC (pH 5.5): 805.02
ACD/LogD (pH 7.4): 2.81
ACD/BCF (pH 7.4): 80.10
ACD/KOC (pH 7.4): 800.94
Polar Surface Area: 143 Å2
Polarizability: 45.5±0.5 10-24cm3
Surface Tension: 69.5±3.0 dyne/cm
Molar Volume: 307.2±3.0 cm3

Click to predict properties on the Chemicalize site


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