ChemSpider 2D Image | 4-Bromo-N-[(6-oxo-5,6-dihydro[1,3]dioxolo[4,5-g]quinolin-7-yl)methyl]-N-(3-pyridinylmethyl)benzenesulfonamide | C23H18BrN3O5S

4-Bromo-N-[(6-oxo-5,6-dihydro[1,3]dioxolo[4,5-g]quinolin-7-yl)methyl]-N-(3-pyridinylmethyl)benzenesulfonamide

  • Molecular FormulaC23H18BrN3O5S
  • Average mass528.375 Da
  • Monoisotopic mass527.015076 Da
  • ChemSpider ID986517

More details:

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

4-Brom-N-[(6-oxo-5,6-dihydro[1,3]dioxolo[4,5-g]chinolin-7-yl)methyl]-N-(3-pyridinylmethyl)benzolsulfonamid [German] [ACD/IUPAC Name]
4-Bromo-N-[(6-oxo-5,6-dihydro[1,3]dioxolo[4,5-g]quinoléin-7-yl)méthyl]-N-(3-pyridinylméthyl)benzènesulfonamide [French] [ACD/IUPAC Name]
4-Bromo-N-[(6-oxo-5,6-dihydro[1,3]dioxolo[4,5-g]quinolin-7-yl)methyl]-N-(3-pyridinylmethyl)benzenesulfonamide [ACD/IUPAC Name]
Benzenesulfonamide, 4-bromo-N-[(5,6-dihydro-6-oxo-1,3-dioxolo[4,5-g]quinolin-7-yl)methyl]-N-(3-pyridinylmethyl)- [ACD/Index Name]

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

ASN 04196419 [DBID]
ZINC00919134 [DBID]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.676
Molar Refractivity: 125.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.89
ACD/LogD (pH 5.5): 3.64
ACD/BCF (pH 5.5): 333.89
ACD/KOC (pH 5.5): 2159.44
ACD/LogD (pH 7.4): 3.69
ACD/BCF (pH 7.4): 372.34
ACD/KOC (pH 7.4): 2408.11
Polar Surface Area: 106 Å2
Polarizability: 49.6±0.5 10-24cm3
Surface Tension: 63.4±3.0 dyne/cm
Molar Volume: 332.4±3.0 cm3

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