ChemSpider 2D Image | 2-(2,3-Dihydro-1H-indol-1-yl)-2-oxoethyl 3-[allyl(4-chlorophenyl)sulfamoyl]benzoate | C26H23ClN2O5S

2-(2,3-Dihydro-1H-indol-1-yl)-2-oxoethyl 3-[allyl(4-chlorophenyl)sulfamoyl]benzoate

  • Molecular FormulaC26H23ClN2O5S
  • Average mass510.989 Da
  • Monoisotopic mass510.101624 Da
  • ChemSpider ID1850095

More details:

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

2-(2,3-Dihydro-1H-indol-1-yl)-2-oxoethyl 3-[allyl(4-chlorophenyl)sulfamoyl]benzoate [ACD/IUPAC Name]
2-(2,3-Dihydro-1H-indol-1-yl)-2-oxoethyl-3-[allyl(4-chlorphenyl)sulfamoyl]benzoat [German] [ACD/IUPAC Name]
3-[Allyl(4-chlorophényl)sulfamoyl]benzoate de 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoéthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-[[(4-chlorophenyl)-2-propen-1-ylamino]sulfonyl]-, 2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl ester [ACD/Index Name]

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

ZINC03361267 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 739.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.9±3.0 kJ/mol
Flash Point: 401.1±35.7 °C
Index of Refraction: 1.644
Molar Refractivity: 134.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 6.28
ACD/LogD (pH 5.5): 5.13
ACD/BCF (pH 5.5): 4625.11
ACD/KOC (pH 5.5): 14624.60
ACD/LogD (pH 7.4): 5.13
ACD/BCF (pH 7.4): 4625.23
ACD/KOC (pH 7.4): 14624.98
Polar Surface Area: 92 Å2
Polarizability: 53.2±0.5 10-24cm3
Surface Tension: 59.1±3.0 dyne/cm
Molar Volume: 370.8±3.0 cm3

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