ChemSpider 2D Image | 10-{2-[(2S)-1-Methyl-2-piperidinyl]ethyl}-2-(methylsulfanyl)-10H-phenothiazin-5-ium-5-olate | C21H26N2OS2

10-{2-[(2S)-1-Methyl-2-piperidinyl]ethyl}-2-(methylsulfanyl)-10H-phenothiazin-5-ium-5-olate

  • Molecular FormulaC21H26N2OS2
  • Average mass386.574 Da
  • Monoisotopic mass386.148651 Da
  • ChemSpider ID34995479

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

10-{2-[(2S)-1-Methyl-2-piperidinyl]ethyl}-2-(methylsulfanyl)-10H-phenothiazin-5-ium-5-olat [German] [ACD/IUPAC Name]
10-{2-[(2S)-1-Methyl-2-piperidinyl]ethyl}-2-(methylsulfanyl)-10H-phenothiazin-5-ium-5-olate [ACD/IUPAC Name]
10-{2-[(2S)-1-Méthyl-2-pipéridinyl]éthyl}-2-(méthylsulfanyl)-10H-phénothiazin-5-ium-5-olate [French] [ACD/IUPAC Name]
10H-Phenothiazinium, 5-hydroxy-10-[2-[(2S)-1-methyl-2-piperidinyl]ethyl]-2-(methylthio)-, inner salt [ACD/Index Name]
7776-05-8 [RN]
THIORIDAZINE 5-SULFOXIDE
UNII-YI69B9MW63

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.695
Molar Refractivity: 113.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 55 Å2
Polarizability: 45.1±0.5 10-24cm3
Surface Tension: 68.1±5.0 dyne/cm
Molar Volume: 295.8±5.0 cm3

Click to predict properties on the Chemicalize site


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