ChemSpider 2D Image | Mozavaptan-d6 | C27H23D6N3O2

Mozavaptan-d6

  • Molecular FormulaC27H23D6N3O2
  • Average mass433.575 Da
  • Monoisotopic mass433.263641 Da
  • ChemSpider ID97091834

  • Non-standard isotope - Non-standard isotope

More details:

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

Benzamide, N-[4-[[5-(dimethyl-d3-amino)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]carbonyl]phenyl]-2-methyl- [ACD/Index Name]
Mozavaptan-d6
N-{4-[(5-{Bis[(2H3)methyl]amino}-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)carbonyl]phenyl}-2-methylbenzamid [German] [ACD/IUPAC Name]
N-{4-[(5-{Bis[(2H3)methyl]amino}-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)carbonyl]phenyl}-2-methylbenzamide [ACD/IUPAC Name]
N-{4-[(5-{Bis[(2H3)méthyl]amino}-2,3,4,5-tétrahydro-1H-1-benzazépin-1-yl)carbonyl]phényl}-2-méthylbenzamide [French] [ACD/IUPAC Name]
2750534-83-7 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 543.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.1±3.0 kJ/mol
Flash Point: 282.2±30.1 °C
Index of Refraction: 1.647
Molar Refractivity: 127.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.83
ACD/LogD (pH 5.5): 0.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.64
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 31.29
ACD/KOC (pH 7.4): 207.12
Polar Surface Area: 53 Å2
Polarizability: 50.5±0.5 10-24cm3
Surface Tension: 57.6±5.0 dyne/cm
Molar Volume: 350.7±5.0 cm3

Click to predict properties on the Chemicalize site


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