ChemSpider 2D Image | 1-(4-(5-((6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isoquinolinyl)methyl)-2-methoxyphenoxy)benzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydro-7-isoquinolinol | C38H44N2O6

1-(4-(5-((6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isoquinolinyl)methyl)-2-methoxyphenoxy)benzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydro-7-isoquinolinol

  • Molecular FormulaC38H44N2O6
  • Average mass624.766 Da
  • Monoisotopic mass624.319946 Da
  • ChemSpider ID283141

More details:






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

1-(4-(5-((6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isoquinolinyl)methyl)-2-methoxyphenoxy)benzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydro-7-isoquinolinol
1-(4-{5-[(6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isochinolinyl)methyl]-2-methoxyphenoxy}benzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydro-7-isochinolinol [German] [ACD/IUPAC Name]
1-(4-{5-[(6,7-Diméthoxy-2-méthyl-1,2,3,4-tétrahydro-1-isoquinoléinyl)méthyl]-2-méthoxyphénoxy}benzyl)-6-méthoxy-2-méthyl-1,2,3,4-tétrahydro-7-isoquinoléinol [French] [ACD/IUPAC Name]
1-(4-{5-[(6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-1-isoquinolinyl)methyl]-2-methoxyphenoxy}benzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydro-7-isoquinolinol [ACD/IUPAC Name]
7-Isoquinolinol, 1,2,3,4-tetrahydro-6-methoxy-1-[[4-[2-methoxy-5-[(1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)methyl]phenoxy]phenyl]methyl]-2-methyl- [ACD/Index Name]
59614-34-5 [RN]
THALIBRINE

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

AIDS132526 [DBID]
AIDS-132526 [DBID]
NSC265453 [DBID]
NSC626654 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 729.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.2±3.0 kJ/mol
Flash Point: 394.8±32.9 °C
Index of Refraction: 1.601
Molar Refractivity: 180.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.49
ACD/LogD (pH 5.5): 1.58
ACD/BCF (pH 5.5): 1.04
ACD/KOC (pH 5.5): 2.63
ACD/LogD (pH 7.4): 4.37
ACD/BCF (pH 7.4): 630.76
ACD/KOC (pH 7.4): 1601.20
Polar Surface Area: 73 Å2
Polarizability: 71.6±0.5 10-24cm3
Surface Tension: 46.8±3.0 dyne/cm
Molar Volume: 526.8±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement