Found 23 results

Search term: MF = 'C_{26}H_{22}BrClN_{2}O_{5}S'
ChemSpider 2D Image | 4-({5-Bromo-1'-[(4-chlorophenyl)sulfonyl]-2-oxospiro[indole-3,4'-piperidin]-1(2H)-yl}methyl)benzoic acid | C26H22BrClN2O5S

4-({5-Bromo-1'-[(4-chlorophenyl)sulfonyl]-2-oxospiro[indole-3,4'-piperidin]-1(2H)-yl}methyl)benzoic acid

  • Molecular FormulaC26H22BrClN2O5S
  • Average mass589.885 Da
  • Monoisotopic mass588.012146 Da
  • ChemSpider ID61729566

More details:

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

4-({5-Brom-1'-[(4-chlorphenyl)sulfonyl]-2-oxospiro[indole-3,4'-piperidin]-1(2H)-yl}methyl)benzoesäure [German] [ACD/IUPAC Name]
4-({5-Bromo-1'-[(4-chlorophenyl)sulfonyl]-2-oxospiro[indole-3,4'-piperidin]-1(2H)-yl}methyl)benzoic acid [ACD/IUPAC Name]
Acide 4-({5-bromo-1'-[(4-chlorophényl)sulfonyl]-2-oxospiro[indole-3,4'-piperidin]-1(2H)-yl}méthyl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[5-bromo-1'-[(4-chlorophenyl)sulfonyl]-2-oxospiro[3H-indole-3,4'-piperidin]-1(2H)-yl]methyl]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 824.4±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 125.6±3.0 kJ/mol
Flash Point: 452.4±37.1 °C
Index of Refraction: 1.737
Molar Refractivity: 140.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 6.41
ACD/LogD (pH 5.5): 4.62
ACD/BCF (pH 5.5): 896.21
ACD/KOC (pH 5.5): 1853.35
ACD/LogD (pH 7.4): 3.08
ACD/BCF (pH 7.4): 26.18
ACD/KOC (pH 7.4): 54.13
Polar Surface Area: 103 Å2
Polarizability: 55.5±0.5 10-24cm3
Surface Tension: 83.8±5.0 dyne/cm
Molar Volume: 348.2±5.0 cm3

Click to predict properties on the Chemicalize site


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