ChemSpider 2D Image | 2-({2-[(4-Chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-methoxy-1H-3,1-benzimidazol-3-ium | C16H15ClN3O2S

2-({2-[(4-Chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-methoxy-1H-3,1-benzimidazol-3-ium

  • Molecular FormulaC16H15ClN3O2S
  • Average mass348.827 Da
  • Monoisotopic mass348.056793 Da
  • ChemSpider ID21221513

  • Charge - Charge

More details:

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

1H-3,1-Benzimidazolium, 2-[[2-[(4-chlorophenyl)amino]-2-oxoethyl]thio]-5-methoxy- [ACD/Index Name]
2-({2-[(4-Chlorophenyl)amino]-2-oxoethyl}sulfanyl)-5-methoxy-1H-3,1-benzimidazol-3-ium [ACD/IUPAC Name]
2-({2-[(4-Chlorophényl)amino]-2-oxoéthyl}sulfanyl)-5-méthoxy-1H-3,1-benzimidazol-3-ium [French] [ACD/IUPAC Name]
2-({2-[(4-Chlorphenyl)amino]-2-oxoethyl}sulfanyl)-5-methoxy-1H-3,1-benzimidazol-3-ium [German] [ACD/IUPAC Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.36
ACD/LogD (pH 5.5): 3.71
ACD/BCF (pH 5.5): 378.29
ACD/KOC (pH 5.5): 2375.26
ACD/LogD (pH 7.4): 3.74
ACD/BCF (pH 7.4): 410.36
ACD/KOC (pH 7.4): 2576.65
Polar Surface Area: 94 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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