ChemSpider 2D Image | 7-Chloro-1-{2-methyl-4-[(2-methylbenzoyl)amino]benzoyl}-2,3,4,5-tetrahydro-1H-1-benzazepin-5-yl dihydrogen phosphate | C26H26ClN2O6P

7-Chloro-1-{2-methyl-4-[(2-methylbenzoyl)amino]benzoyl}-2,3,4,5-tetrahydro-1H-1-benzazepin-5-yl dihydrogen phosphate

  • Molecular FormulaC26H26ClN2O6P
  • Average mass528.921 Da
  • Monoisotopic mass528.121704 Da
  • ChemSpider ID17342600

More details:

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

7-Chlor-1-{2-methyl-4-[(2-methylbenzoyl)amino]benzoyl}-2,3,4,5-tetrahydro-1H-1-benzazepin-5-yldihydrogenphosphat [German] [ACD/IUPAC Name]
7-Chloro-1-{2-methyl-4-[(2-methylbenzoyl)amino]benzoyl}-2,3,4,5-tetrahydro-1H-1-benzazepin-5-yl dihydrogen phosphate [ACD/IUPAC Name]
Benzamide, N-[4-[[7-chloro-2,3,4,5-tetrahydro-5-(phosphonooxy)-1H-1-benzazepin-1-yl]carbonyl]-3-methylphenyl]-2-methyl- [ACD/Index Name]
Dihydrogénophosphate de 7-chloro-1-{2-méthyl-4-[(2-méthylbenzoyl)amino]benzoyl}-2,3,4,5-tétrahydro-1H-1-benzazépin-5-yle [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.665
Molar Refractivity: 135.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 3.23
ACD/LogD (pH 5.5): -0.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 126 Å2
Polarizability: 53.6±0.5 10-24cm3
Surface Tension: 71.8±5.0 dyne/cm
Molar Volume: 364.4±5.0 cm3

Click to predict properties on the Chemicalize site


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