ChemSpider 2D Image | Ethyl 4-{[(7-methoxy-2-oxo-1,2-dihydro-3-quinolinyl)methyl](2-thienylmethyl)sulfamoyl}benzoate | C25H24N2O6S2

Ethyl 4-{[(7-methoxy-2-oxo-1,2-dihydro-3-quinolinyl)methyl](2-thienylmethyl)sulfamoyl}benzoate

  • Molecular FormulaC25H24N2O6S2
  • Average mass512.598 Da
  • Monoisotopic mass512.107605 Da
  • ChemSpider ID985914

More details:

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

4-{[(7-Méthoxy-2-oxo-1,2-dihydro-3-quinoléinyl)méthyl](2-thiénylméthyl)sulfamoyl}benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[[(1,2-dihydro-7-methoxy-2-oxo-3-quinolinyl)methyl](2-thienylmethyl)amino]sulfonyl]-, ethyl ester [ACD/Index Name]
Ethyl 4-{[(7-methoxy-2-oxo-1,2-dihydro-3-quinolinyl)methyl](2-thienylmethyl)sulfamoyl}benzoate [ACD/IUPAC Name]
Ethyl-4-{[(7-methoxy-2-oxo-1,2-dihydro-3-chinolinyl)methyl](2-thienylmethyl)sulfamoyl}benzoat [German] [ACD/IUPAC Name]
ETHYL 4-{[(7-METHOXY-2-OXO-1H-QUINOLIN-3-YL)METHYL](THIOPHEN-2-YLMETHYL)SULFAMOYL}BENZOATE

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

ASN 04194813 [DBID]
ZINC00917866 [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.622
Molar Refractivity: 133.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.89
ACD/LogD (pH 5.5): 4.64
ACD/BCF (pH 5.5): 1971.01
ACD/KOC (pH 5.5): 7942.07
ACD/LogD (pH 7.4): 4.64
ACD/BCF (pH 7.4): 1969.84
ACD/KOC (pH 7.4): 7937.37
Polar Surface Area: 139 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 54.4±3.0 dyne/cm
Molar Volume: 379.7±3.0 cm3

Click to predict properties on the Chemicalize site


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