Found 164 results

Search term: MF = 'C_{35}H_{40}N_{4}O'
ChemSpider 2D Image | 6-(Benzyloxy)-1,1-dibutyl-3-(5-phenyl-1H-imidazol-2-yl)-2,3,4,9-tetrahydro-1H-beta-carboline | C35H40N4O

6-(Benzyloxy)-1,1-dibutyl-3-(5-phenyl-1H-imidazol-2-yl)-2,3,4,9-tetrahydro-1H-β-carboline

  • Molecular FormulaC35H40N4O
  • Average mass532.718 Da
  • Monoisotopic mass532.320190 Da
  • ChemSpider ID9224912

More details:

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

1H-Pyrido[3,4-b]indole, 1,1-dibutyl-2,3,4,9-tetrahydro-3-(5-phenyl-1H-imidazol-2-yl)-6-(phenylmethoxy)- [ACD/Index Name]
6-(Benzyloxy)-1,1-dibutyl-3-(5-phenyl-1H-imidazol-2-yl)-2,3,4,9-tetrahydro-1H-β-carbolin [German] [ACD/IUPAC Name]
6-(Benzyloxy)-1,1-dibutyl-3-(5-phenyl-1H-imidazol-2-yl)-2,3,4,9-tetrahydro-1H-β-carboline [ACD/IUPAC Name]
6-(Benzyloxy)-1,1-dibutyl-3-(5-phényl-1H-imidazol-2-yl)-2,3,4,9-tétrahydro-1H-β-carboline [French] [ACD/IUPAC Name]
6-Benzyloxy-1,1-dibutyl-3-(4-phenyl-1H-imidazol-2-yl)-2,3,4,9-tetrahydro-1H-β-carboline
CHEMBL317851
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL317851/

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

Density: 1.1±0.1 g/cm3
Boiling Point: 769.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.0±3.0 kJ/mol
Flash Point: 419.0±32.9 °C
Index of Refraction: 1.614
Molar Refractivity: 163.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 9.05
ACD/LogD (pH 5.5): 4.59
ACD/BCF (pH 5.5): 333.88
ACD/KOC (pH 5.5): 298.22
ACD/LogD (pH 7.4): 5.99
ACD/BCF (pH 7.4): 8387.31
ACD/KOC (pH 7.4): 7491.61
Polar Surface Area: 66 Å2
Polarizability: 65.0±0.5 10-24cm3
Surface Tension: 50.1±3.0 dyne/cm
Molar Volume: 470.1±3.0 cm3

Click to predict properties on the Chemicalize site


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