ChemSpider 2D Image | 1-[4-({5-[2-(Dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl}oxy)-4-oxobutyl]-1,2-triazadien-2-ium | C24H30N5O4S

1-[4-({5-[2-(Dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl}oxy)-4-oxobutyl]-1,2-triazadien-2-ium

  • Molecular FormulaC24H30N5O4S
  • Average mass484.591 Da
  • Monoisotopic mass484.201294 Da
  • ChemSpider ID95667551

  • Charge - Charge

More details:

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

1,2-Triazadien-2-ium, 1-[4-[[5-[2-(dimethylamino)ethyl]-2,3,4,5-tetrahydro-2-(4-methoxyphenyl)-4-oxo-1,5-benzothiazepin-3-yl]oxy]-4-oxobutyl]- [ACD/Index Name]
1-[4-({5-[2-(Dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl}oxy)-4-oxobutyl]-1,2-triazadien-2-ium [German] [ACD/IUPAC Name]
1-[4-({5-[2-(Dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl}oxy)-4-oxobutyl]-1,2-triazadien-2-ium [ACD/IUPAC Name]
1-[4-({5-[2-(Diméthylamino)éthyl]-2-(4-méthoxyphényl)-4-oxo-2,3,4,5-tétrahydro-1,5-benzothiazépin-3-yl}oxy)-4-oxobutyl]-1,2-triazadién-2-ium [French] [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: 9
#H bond donors: 1
#Freely Rotating Bonds: 11
#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: 121 Å2
Polarizability:
Surface Tension:
Molar Volume:

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