ChemSpider 2D Image | Ethyl 3-({10-[(2-methoxyphenyl)carbamoyl]-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinolin-11-ylidene}amino)benzoate | C32H31N3O5

Ethyl 3-({10-[(2-methoxyphenyl)carbamoyl]-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinolin-11-ylidene}amino)benzoate

  • Molecular FormulaC32H31N3O5
  • Average mass537.606 Da
  • Monoisotopic mass537.226379 Da
  • ChemSpider ID35369419

More details:

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

3-({10-[(2-Méthoxyphényl)carbamoyl]-2,3,6,7-tétrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinoléin-11-ylidène}amino)benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-[[2,3,6,7-tetrahydro-10-[[(2-methoxyphenyl)amino]carbonyl]-1H,5H,11H-[1]benzopyrano[6,7,8-ij]quinolizin-11-ylidene]amino]-, ethyl ester [ACD/Index Name]
Ethyl 3-({10-[(2-methoxyphenyl)carbamoyl]-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinolin-11-ylidene}amino)benzoate [ACD/IUPAC Name]
Ethyl-3-({10-[(2-methoxyphenyl)carbamoyl]-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]chinolin-11-yliden}amino)benzoat [German] [ACD/IUPAC Name]
1321918-77-7 [RN]
ethyl 3-{[(4Z)-5-[(2-methoxyphenyl)carbamoyl]-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-ylidene]amino}benzoate

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.658
Molar Refractivity: 150.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 7.62
ACD/LogD (pH 5.5): 6.50
ACD/BCF (pH 5.5): 44831.98
ACD/KOC (pH 5.5): 63260.37
ACD/LogD (pH 7.4): 6.74
ACD/BCF (pH 7.4): 78058.77
ACD/KOC (pH 7.4): 110145.18
Polar Surface Area: 89 Å2
Polarizability: 59.6±0.5 10-24cm3
Surface Tension: 50.5±7.0 dyne/cm
Molar Volume: 408.3±7.0 cm3

Click to predict properties on the Chemicalize site


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