ChemSpider 2D Image | N-[3-(1-Azepanylsulfonyl)phenyl]-4-(3,4-dihydro-1(2H)-quinolinylsulfonyl)benzamide | C28H31N3O5S2

N-[3-(1-Azepanylsulfonyl)phenyl]-4-(3,4-dihydro-1(2H)-quinolinylsulfonyl)benzamide

  • Molecular FormulaC28H31N3O5S2
  • Average mass553.693 Da
  • Monoisotopic mass553.170532 Da
  • ChemSpider ID2710973

More details:

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

Benzamide, 4-[(3,4-dihydro-1(2H)-quinolinyl)sulfonyl]-N-[3-[(hexahydro-1H-azepin-1-yl)sulfonyl]phenyl]- [ACD/Index Name]
N-[3-(1-Azepanylsulfonyl)phenyl]-4-(3,4-dihydro-1(2H)-chinolinylsulfonyl)benzamid [German] [ACD/IUPAC Name]
N-[3-(1-Azépanylsulfonyl)phényl]-4-(3,4-dihydro-1(2H)-quinoléinylsulfonyl)benzamide [French] [ACD/IUPAC Name]
N-[3-(1-Azepanylsulfonyl)phenyl]-4-(3,4-dihydro-1(2H)-quinolinylsulfonyl)benzamide [ACD/IUPAC Name]

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: 1.646
Molar Refractivity: 147.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.02
ACD/LogD (pH 5.5): 3.97
ACD/BCF (pH 5.5): 613.72
ACD/KOC (pH 5.5): 3445.32
ACD/LogD (pH 7.4): 3.97
ACD/BCF (pH 7.4): 613.70
ACD/KOC (pH 7.4): 3445.23
Polar Surface Area: 121 Å2
Polarizability: 58.5±0.5 10-24cm3
Surface Tension: 60.3±3.0 dyne/cm
Molar Volume: 406.5±3.0 cm3

Click to predict properties on the Chemicalize site


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