ChemSpider 2D Image | (4-{2-[({[5-(2-Pyridinylsulfanyl)-1,3-thiazol-2-yl]carbamoyl}amino)methyl]-1H-imidazol-4-yl}phenoxy)acetate | C21H17N6O4S2

(4-{2-[({[5-(2-Pyridinylsulfanyl)-1,3-thiazol-2-yl]carbamoyl}amino)methyl]-1H-imidazol-4-yl}phenoxy)acetate

  • Molecular FormulaC21H17N6O4S2
  • Average mass481.528 Da
  • Monoisotopic mass481.075806 Da
  • ChemSpider ID34894100

  • Charge - Charge

More details:

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

(4-{2-[({[5-(2-Pyridinylsulfanyl)-1,3-thiazol-2-yl]carbamoyl}amino)methyl]-1H-imidazol-4-yl}phenoxy)acetat [German] [ACD/IUPAC Name]
(4-{2-[({[5-(2-Pyridinylsulfanyl)-1,3-thiazol-2-yl]carbamoyl}amino)methyl]-1H-imidazol-4-yl}phenoxy)acetate [ACD/IUPAC Name]
(4-{2-[({[5-(2-Pyridinylsulfanyl)-1,3-thiazol-2-yl]carbamoyl}amino)méthyl]-1H-imidazol-4-yl}phénoxy)acétate [French] [ACD/IUPAC Name]
Acetic acid, 2-[4-[2-[[[[[5-(2-pyridinylthio)-2-thiazolyl]amino]carbonyl]amino]methyl]-1H-imidazol-4-yl]phenoxy]-, ion(1-) [ACD/Index 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: 10
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 2.58
ACD/LogD (pH 5.5): -0.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 198 Å2
Polarizability:
Surface Tension:
Molar Volume:

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