Found 1 result

Search term: AGDXSBRQWSRVSZ-UHFFFAOYAK (Found by InChIKey (full match))
ChemSpider 2D Image | 2,2'-[1,4-Piperazinediylbis(methylene)]bis(10,10a-dihydroimidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione) | C28H30N6O4

2,2'-[1,4-Piperazinediylbis(methylene)]bis(10,10a-dihydroimidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione)

  • Molecular FormulaC28H30N6O4
  • Average mass514.576 Da
  • Monoisotopic mass514.232849 Da
  • ChemSpider ID329627

More details:

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

2-((4-((1,3-Dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl)methyl)-1-piperazinyl)methyl)-10,10a-dihydroimidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione
2,2'-(1,4-Piperazindiyldimethylen)bis(10,10a-dihydroimidazo[1,5-b]isochinolin-1,3(2H,5H)-dion) [German] [ACD/IUPAC Name]
2,2'-(1,4-Pipérazinediyldiméthylène)bis(10,10a-dihydroimidazo[1,5-b]isoquinoléine-1,3(2H,5H)-dione) [French] [ACD/IUPAC Name]
2,2'-[1,4-Piperazinediylbis(methylene)]bis(10,10a-dihydroimidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione) [ACD/IUPAC Name]
Imidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione, 2,2'-[1,4-piperazinediylbis(methylene)]bis[10,10a-dihydro- [ACD/Index Name]

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

AIDS138547 [DBID]
AIDS-138547 [DBID]
NCI60_015571 [DBID]
NSC645587 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 680.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.8±3.0 kJ/mol
Flash Point: 296.3±26.6 °C
Index of Refraction: 1.748
Molar Refractivity: 139.0±0.4 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 0.77
ACD/LogD (pH 5.5): 1.07
ACD/BCF (pH 5.5): 2.60
ACD/KOC (pH 5.5): 43.51
ACD/LogD (pH 7.4): 1.75
ACD/BCF (pH 7.4): 12.55
ACD/KOC (pH 7.4): 209.76
Polar Surface Area: 88 Å2
Polarizability: 55.1±0.5 10-24cm3
Surface Tension: 86.2±5.0 dyne/cm
Molar Volume: 342.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement