ChemSpider 2D Image | N-[(3-{[4-Chloro-2-(2-pyridinylsulfonyl)phenyl]sulfonyl}-3-azabicyclo[3.1.0]hex-6-yl)methyl]methanesulfonamide | C18H20ClN3O6S3

N-[(3-{[4-Chloro-2-(2-pyridinylsulfonyl)phenyl]sulfonyl}-3-azabicyclo[3.1.0]hex-6-yl)methyl]methanesulfonamide

  • Molecular FormulaC18H20ClN3O6S3
  • Average mass506.016 Da
  • Monoisotopic mass505.020264 Da
  • ChemSpider ID9679150

More details:

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

Methanesulfonamide, N-[[3-[[4-chloro-2-(2-pyridinylsulfonyl)phenyl]sulfonyl]-3-azabicyclo[3.1.0]hex-6-yl]methyl]- [ACD/Index Name]
N-[(3-{[4-Chlor-2-(2-pyridinylsulfonyl)phenyl]sulfonyl}-3-azabicyclo[3.1.0]hex-6-yl)methyl]methansulfonamid [German] [ACD/IUPAC Name]
N-[(3-{[4-Chloro-2-(2-pyridinylsulfonyl)phenyl]sulfonyl}-3-azabicyclo[3.1.0]hex-6-yl)methyl]methanesulfonamide [ACD/IUPAC Name]
N-[(3-{[4-Chloro-2-(2-pyridinylsulfonyl)phényl]sulfonyl}-3-azabicyclo[3.1.0]hex-6-yl)méthyl]méthanesulfonamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 732.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.9±3.0 kJ/mol
Flash Point: 396.8±35.7 °C
Index of Refraction: 1.631
Molar Refractivity: 116.3±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 2.15
ACD/LogD (pH 5.5): 2.49
ACD/BCF (pH 5.5): 46.31
ACD/KOC (pH 5.5): 541.92
ACD/LogD (pH 7.4): 2.49
ACD/BCF (pH 7.4): 46.31
ACD/KOC (pH 7.4): 541.83
Polar Surface Area: 156 Å2
Polarizability: 46.1±0.5 10-24cm3
Surface Tension: 62.1±3.0 dyne/cm
Molar Volume: 326.8±3.0 cm3

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