ChemSpider 2D Image | 3-Bromo-N-{4-chloro-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}benzamide | C21H15BrClN3O4

3-Bromo-N-{4-chloro-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}benzamide

  • Molecular FormulaC21H15BrClN3O4
  • Average mass488.719 Da
  • Monoisotopic mass486.993439 Da
  • ChemSpider ID25952111

More details:

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

3-Brom-N-{4-chlor-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}benzamid [German] [ACD/IUPAC Name]
3-Bromo-N-{4-chloro-2-[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl}benzamide [ACD/IUPAC Name]
3-Bromo-N-{4-chloro-2-[(2-méthyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)méthoxy]phényl}benzamide [French] [ACD/IUPAC Name]
Benzamide, 3-bromo-N-[4-chloro-2-[(2-methyl-7-oxo-7H-isoxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]- [ACD/Index Name]
3-Bromo-N-[4-chloro-2-(2-methyl-7-oxo-7H-isoxazolo[2,3-a]pyrimidin-5-ylmethoxy)-phenyl]-benzamide

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.683
Molar Refractivity: 115.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.91
ACD/LogD (pH 5.5): 3.77
ACD/BCF (pH 5.5): 430.15
ACD/KOC (pH 5.5): 2671.48
ACD/LogD (pH 7.4): 3.77
ACD/BCF (pH 7.4): 430.14
ACD/KOC (pH 7.4): 2671.40
Polar Surface Area: 80 Å2
Polarizability: 45.8±0.5 10-24cm3
Surface Tension: 55.9±7.0 dyne/cm
Molar Volume: 305.1±7.0 cm3

Click to predict properties on the Chemicalize site


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