ChemSpider 2D Image | 2-[(11aS)-1,3-Dioxo-5-phenyl-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]-N-hexylbenzamide | C32H32N4O3

2-[(11aS)-1,3-Dioxo-5-phenyl-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]-N-hexylbenzamide

  • Molecular FormulaC32H32N4O3
  • Average mass520.622 Da
  • Monoisotopic mass520.247437 Da
  • ChemSpider ID17469540
  • defined stereocentres - 1 of 2 defined stereocentres


More details:






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

2-[(11aS)-1,3-Dioxo-5-phenyl-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]-N-hexylbenzamid [German] [ACD/IUPAC Name]
2-[(11aS)-1,3-Dioxo-5-phenyl-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]-N-hexylbenzamide [ACD/IUPAC Name]
2-[(11aS)-1,3-Dioxo-5-phényl-5,6,11,11a-tétrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]-N-hexylbenzamide [French] [ACD/IUPAC Name]
Benzamide, N-hexyl-2-[(11aS)-5,6,11,11a-tetrahydro-1,3-dioxo-5-phenyl-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]- [ACD/Index Name]
2-((11aS)-1,3-dioxo-5-phenyl-11,11a-dihydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H,5H,6H)-yl)-N-hexylbenzamide
956914-84-4 [RN]
c32h32n4o3
MCULE-7824670805
MolPort-002-531-425
STOCK1N-60767

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.699
Molar Refractivity: 150.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.94
ACD/LogD (pH 5.5): 5.92
ACD/BCF (pH 5.5): 18669.00
ACD/KOC (pH 5.5): 39705.90
ACD/LogD (pH 7.4): 5.92
ACD/BCF (pH 7.4): 18669.00
ACD/KOC (pH 7.4): 39705.90
Polar Surface Area: 86 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 69.6±5.0 dyne/cm
Molar Volume: 390.6±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement