Found 48 results

Search term: MF = 'C_{24}H_{23}BrN_{2}O_{4}S_{2}'
ChemSpider 2D Image | Ethyl 2-[({[(1-bromo-2-naphthyl)oxy]acetyl}carbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate | C24H23BrN2O4S2

Ethyl 2-[({[(1-bromo-2-naphthyl)oxy]acetyl}carbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

  • Molecular FormulaC24H23BrN2O4S2
  • Average mass547.484 Da
  • Monoisotopic mass546.028259 Da
  • ChemSpider ID3674564

More details:

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

2-[({2-[(1-Bromo-2-naphtyl)oxy]acétyl}carbamothioyl)amino]-4,5,6,7-tétrahydro-1-benzothiophène-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Benzo[b]thiophene-3-carboxylic acid, 2-[[[[2-[(1-bromo-2-naphthalenyl)oxy]acetyl]amino]thioxomethyl]amino]-4,5,6,7-tetrahydro-, ethyl ester [ACD/Index Name]
Ethyl 2-[({[(1-bromo-2-naphthyl)oxy]acetyl}carbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate [ACD/IUPAC Name]
Ethyl-2-[({[(1-brom-2-naphthyl)oxy]acetyl}carbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophen-3-carboxylat [German] [ACD/IUPAC Name]
ethyl 2-{[({[(1-bromo-2-naphthyl)oxy]acetyl}amino)carbonothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

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: 1.696
Molar Refractivity: 139.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 8.11
ACD/LogD (pH 5.5): 6.68
ACD/BCF (pH 5.5): 69923.03
ACD/KOC (pH 5.5): 102006.73
ACD/LogD (pH 7.4): 6.51
ACD/BCF (pH 7.4): 47863.94
ACD/KOC (pH 7.4): 69825.98
Polar Surface Area: 137 Å2
Polarizability: 55.3±0.5 10-24cm3
Surface Tension: 64.3±3.0 dyne/cm
Molar Volume: 362.2±3.0 cm3

Click to predict properties on the Chemicalize site


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