ChemSpider 2D Image | N-{4-[4-(1-Azepanylsulfonyl)phenyl]-1,3-thiazol-2-yl}-6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamide | C29H32N4O5S2

N-{4-[4-(1-Azepanylsulfonyl)phenyl]-1,3-thiazol-2-yl}-6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamide

  • Molecular FormulaC29H32N4O5S2
  • Average mass580.718 Da
  • Monoisotopic mass580.181396 Da
  • ChemSpider ID2592364

More details:

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

2H-Isoindole-2-hexanamide, N-[4-[4-[(hexahydro-1H-azepin-1-yl)sulfonyl]phenyl]-2-thiazolyl]-1,3-dihydro-1,3-dioxo- [ACD/Index Name]
N-{4-[4-(1-Azepanylsulfonyl)phenyl]-1,3-thiazol-2-yl}-6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamid [German] [ACD/IUPAC Name]
N-{4-[4-(1-Azepanylsulfonyl)phenyl]-1,3-thiazol-2-yl}-6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamide [ACD/IUPAC Name]
N-{4-[4-(1-Azépanylsulfonyl)phényl]-1,3-thiazol-2-yl}-6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamide [French] [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: 1.636
Molar Refractivity: 153.4±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.50
ACD/LogD (pH 5.5): 4.34
ACD/BCF (pH 5.5): 1166.11
ACD/KOC (pH 5.5): 5454.37
ACD/LogD (pH 7.4): 4.33
ACD/BCF (pH 7.4): 1155.73
ACD/KOC (pH 7.4): 5405.83
Polar Surface Area: 153 Å2
Polarizability: 60.8±0.5 10-24cm3
Surface Tension: 62.6±3.0 dyne/cm
Molar Volume: 428.2±3.0 cm3

Click to predict properties on the Chemicalize site


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