ChemSpider 2D Image | N-(1,3-Benzodioxol-5-ylmethyl)-3-chloro-N-[(6-methoxy-2-oxo-1,2-dihydro-3-quinolinyl)methyl]-4-methylbenzenesulfonamide | C26H23ClN2O6S

N-(1,3-Benzodioxol-5-ylmethyl)-3-chloro-N-[(6-methoxy-2-oxo-1,2-dihydro-3-quinolinyl)methyl]-4-methylbenzenesulfonamide

  • Molecular FormulaC26H23ClN2O6S
  • Average mass526.989 Da
  • Monoisotopic mass526.096558 Da
  • ChemSpider ID986160

More details:

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

Benzenesulfonamide, N-(1,3-benzodioxol-5-ylmethyl)-3-chloro-N-[(1,2-dihydro-6-methoxy-2-oxo-3-quinolinyl)methyl]-4-methyl- [ACD/Index Name]
N-(1,3-Benzodioxol-5-ylmethyl)-3-chlor-N-[(6-methoxy-2-oxo-1,2-dihydro-3-chinolinyl)methyl]-4-methylbenzolsulfonamid [German] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylméthyl)-3-chloro-N-[(6-méthoxy-2-oxo-1,2-dihydro-3-quinoléinyl)méthyl]-4-méthylbenzènesulfonamide [French] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylmethyl)-3-chloro-N-[(6-methoxy-2-oxo-1,2-dihydro-3-quinolinyl)methyl]-4-methylbenzenesulfonamide [ACD/IUPAC Name]

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

ASN 04195218 [DBID]
ZINC00918224 [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: 1.641
Molar Refractivity: 135.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.26
ACD/LogD (pH 5.5): 4.97
ACD/BCF (pH 5.5): 3534.65
ACD/KOC (pH 5.5): 12064.22
ACD/LogD (pH 7.4): 4.97
ACD/BCF (pH 7.4): 3532.19
ACD/KOC (pH 7.4): 12055.85
Polar Surface Area: 103 Å2
Polarizability: 53.6±0.5 10-24cm3
Surface Tension: 55.8±3.0 dyne/cm
Molar Volume: 375.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement