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

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

  • Molecular FormulaC32H32N4O3
  • Average mass520.622 Da
  • Monoisotopic mass520.247437 Da
  • ChemSpider ID17468816
  • defined stereocentres - 1 of 2 defined stereocentres


More details:






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

2-[(11aS)-5-(4-Isopropylphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]-N-propylbenzamid [German] [ACD/IUPAC Name]
2-[(11aS)-5-(4-Isopropylphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]-N-propylbenzamide [ACD/IUPAC Name]
2-[(11aS)-5-(4-Isopropylphényl)-1,3-dioxo-5,6,11,11a-tétrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]-N-propylbenzamide [French] [ACD/IUPAC Name]
Benzamide, N-propyl-2-[(11aS)-5,6,11,11a-tetrahydro-5-[4-(1-methylethyl)phenyl]-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]- [ACD/Index Name]
2-((11aS)-5-(4-isopropylphenyl)-1,3-dioxo-11,11a-dihydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H,5H,6H)-yl)-N-propylbenzamide
956991-07-4 [RN]
c32h32n4o3

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: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.68
ACD/LogD (pH 5.5): 4.83
ACD/BCF (pH 5.5): 2750.83
ACD/KOC (pH 5.5): 10082.39
ACD/LogD (pH 7.4): 4.83
ACD/BCF (pH 7.4): 2750.83
ACD/KOC (pH 7.4): 10082.39
Polar Surface Area: 86 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 68.6±5.0 dyne/cm
Molar Volume: 390.7±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement