ChemSpider 2D Image | 1-[6-(5-Methoxy-3-pyridinyl)-1,3-benzothiazol-2-yl]-3-[2-(1-propyl-1H-imidazol-4-yl)ethyl]urea | C22H24N6O2S

1-[6-(5-Methoxy-3-pyridinyl)-1,3-benzothiazol-2-yl]-3-[2-(1-propyl-1H-imidazol-4-yl)ethyl]urea

  • Molecular FormulaC22H24N6O2S
  • Average mass436.530 Da
  • Monoisotopic mass436.168152 Da
  • ChemSpider ID35034975

More details:

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

1-[6-(5-Methoxy-3-pyridinyl)-1,3-benzothiazol-2-yl]-3-[2-(1-propyl-1H-imidazol-4-yl)ethyl]harnstoff [German] [ACD/IUPAC Name]
1-[6-(5-Methoxy-3-pyridinyl)-1,3-benzothiazol-2-yl]-3-[2-(1-propyl-1H-imidazol-4-yl)ethyl]urea [ACD/IUPAC Name]
1-[6-(5-Méthoxy-3-pyridinyl)-1,3-benzothiazol-2-yl]-3-[2-(1-propyl-1H-imidazol-4-yl)éthyl]urée [French] [ACD/IUPAC Name]
1-[6-(5-Methoxypyridin-3-Yl)-1,3-Benzothiazol-2-Yl]-3-[2-(1-Propyl-1h-Imidazol-4-Yl)ethyl]urea
Urea, N-[6-(5-methoxy-3-pyridinyl)-2-benzothiazolyl]-N'-[2-(1-propyl-1H-imidazol-4-yl)ethyl]- [ACD/Index Name]
2WH

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.683
Molar Refractivity: 122.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.13
ACD/LogD (pH 5.5): 1.52
ACD/BCF (pH 5.5): 3.74
ACD/KOC (pH 5.5): 34.06
ACD/LogD (pH 7.4): 2.62
ACD/BCF (pH 7.4): 47.16
ACD/KOC (pH 7.4): 429.40
Polar Surface Area: 122 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 54.1±7.0 dyne/cm
Molar Volume: 323.3±7.0 cm3

Click to predict properties on the Chemicalize site


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