ChemSpider 2D Image | (R)-TACRINE(10)-HUPYRIDONE | C32H44N4O

(R)-TACRINE(10)-HUPYRIDONE

  • Molecular FormulaC32H44N4O
  • Average mass500.718 Da
  • Monoisotopic mass500.351501 Da
  • ChemSpider ID4484242

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(5R)-5-{[10-(1,2,3,4-Tetrahydro-9-acridinylamino)decyl]amino}-5,6,7,8-tetrahydro-2(1H)-chinolinon [German] [ACD/IUPAC Name]
(5R)-5-{[10-(1,2,3,4-Tétrahydro-9-acridinylamino)décyl]amino}-5,6,7,8-tétrahydro-2(1H)-quinoléinone [French] [ACD/IUPAC Name]
(5R)-5-{[10-(1,2,3,4-Tetrahydro-9-acridinylamino)decyl]amino}-5,6,7,8-tetrahydro-2(1H)-quinolinone [ACD/IUPAC Name]
(R)-TACRINE(10)-HUPYRIDONE
2(1H)-Quinolinone, 5,6,7,8-tetrahydro-5-[[10-[(1,2,3,4-tetrahydro-9-acridinyl)amino]decyl]amino]-, (5R)- [ACD/Index Name]
(5R)-5-({10-[(1,2,3,4-tetrahydroacridin-9-yl)amino]decyl}amino)-1,2,5,6,7,8-hexahydroquinolin-2-one
(5R)-5-{[10-(1,2,3,4-TETRAHYDROACRIDIN-9-YLAMINO)DECYL]AMINO}-5,6,7,8-TETRAHYDROQUINOLIN-2(1H)-ONE
(R)-N-9 -(1 ,2 ,3 ,4 -TETRAHYDROACRIDINYL)-N'-5 -[5 ,6 ,7 ,8 -TETRAHYDRO-2'(1'H)-QUINOLINONYL]-1,10-DIAMINODECANE
A1E

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

Density: 1.1±0.1 g/cm3
Boiling Point: 751.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.5±3.0 kJ/mol
Flash Point: 408.0±32.9 °C
Index of Refraction: 1.612
Molar Refractivity: 152.9±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 7.06
ACD/LogD (pH 5.5): 2.40
ACD/BCF (pH 5.5): 4.10
ACD/KOC (pH 5.5): 6.65
ACD/LogD (pH 7.4): 4.13
ACD/BCF (pH 7.4): 221.09
ACD/KOC (pH 7.4): 358.23
Polar Surface Area: 66 Å2
Polarizability: 60.6±0.5 10-24cm3
Surface Tension: 53.6±5.0 dyne/cm
Molar Volume: 439.5±5.0 cm3

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