ChemSpider 2D Image | N-Cyclopentyl-2-(1-hydroxy-3,3-dimethyl-11-phenyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl)acetamide | C28H33N3O2

N-Cyclopentyl-2-(1-hydroxy-3,3-dimethyl-11-phenyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl)acetamide

  • Molecular FormulaC28H33N3O2
  • Average mass443.581 Da
  • Monoisotopic mass443.257263 Da
  • ChemSpider ID21113414

More details:

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

10H-Dibenzo[b,e][1,4]diazepine-10-acetamide, N-cyclopentyl-2,3,4,11-tetrahydro-1-hydroxy-3,3-dimethyl-11-phenyl- [ACD/Index Name]
N-Cyclopentyl-2-(1-hydroxy-3,3-dimethyl-11-phenyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl)acetamid [German] [ACD/IUPAC Name]
N-Cyclopentyl-2-(1-hydroxy-3,3-dimethyl-11-phenyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl)acetamide [ACD/IUPAC Name]
N-Cyclopentyl-2-(1-hydroxy-3,3-diméthyl-11-phényl-2,3,4,11-tétrahydro-10H-dibenzo[b,e][1,4]diazépin-10-yl)acétamide [French] [ACD/IUPAC Name]
N-Cyclopentyl-2-(1-hydroxy-3,3-dimethyl-11-phenyl-2,3,4,11-tetrahydro-dibenzo[b,e][1,4]diazepin-10-yl)-acetamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 655.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.4±3.0 kJ/mol
Flash Point: 350.0±31.5 °C
Index of Refraction: 1.650
Molar Refractivity: 130.8±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 4.39
ACD/BCF (pH 5.5): 1192.01
ACD/KOC (pH 5.5): 5075.72
ACD/LogD (pH 7.4): 4.51
ACD/BCF (pH 7.4): 1551.32
ACD/KOC (pH 7.4): 6605.70
Polar Surface Area: 65 Å2
Polarizability: 51.8±0.5 10-24cm3
Surface Tension: 48.4±7.0 dyne/cm
Molar Volume: 358.7±7.0 cm3

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