ChemSpider 2D Image | Amino[3-({4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-2-oxo-1-piperazinyl}methyl)phenyl]methaniminium | C20H20ClN4O3S2

Amino[3-({4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-2-oxo-1-piperazinyl}methyl)phenyl]methaniminium

  • Molecular FormulaC20H20ClN4O3S2
  • Average mass463.980 Da
  • Monoisotopic mass463.065979 Da
  • ChemSpider ID21201341

  • Charge - Charge

More details:

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

Amino[3-({4-[(6-chlor-1-benzothiophen-2-yl)sulfonyl]-2-oxo-1-piperazinyl}methyl)phenyl]methaniminium [German] [ACD/IUPAC Name]
Amino[3-({4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-2-oxo-1-piperazinyl}methyl)phenyl]methaniminium [ACD/IUPAC Name]
Amino[3-({4-[(6-chloro-1-benzothiophén-2-yl)sulfonyl]-2-oxo-1-pipérazinyl}méthyl)phényl]méthaniminium [French] [ACD/IUPAC Name]
Benzenemethaniminium, α-amino-3-[[4-[(6-chlorobenzo[b]thien-2-yl)sulfonyl]-2-oxo-1-piperazinyl]methyl]- [ACD/Index Name]

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

Density:
Boiling Point: 729.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.5±3.0 kJ/mol
Flash Point: 395.0±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.49
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.43
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 1.01
ACD/KOC (pH 7.4): 9.51
Polar Surface Area: 146 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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