4-ethoxy-7,8-dimethoxyfuro[2,3-b]quinoline

• ChemBase ID: 217486
• Molecular Formular: C15H15NO4
• Molecular Mass: 273.2839
• Monoisotopic Mass: 273.10010797
• SMILES: c12nc3c(c(c1ccc(c2OC)OC)OCC)cco3
• Canonical SMILES: CCOc1c2ccc(c(c2nc2c1cco2)OC)OC
• InChI: InChI=1S/C15H15NO4/c1-4-19-13-9-5-6-11(17-2)14(18-3)12(9)16-15-10(13)7-8-20-15/h5-8H,4H2,1-3H3
• InChIKey: QSGZRSBPMIEJQQ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-ethoxy-7,8-dimethoxyfuro[2,3-b]quinoline
• IUPAC Traditional name: 4-ethoxy-7,8-dimethoxyfuro[2,3-b]quinoline

Database IDs

• PubChem SID: 164273396
• PubChem CID: 8016789

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): 2.5412042
• LogD (pH = 7.4): 2.541279
• Log P: 2.54128
• Molar Refractivity: 72.9112 cm^3
• Polarizability: 30.056252 Å^3
• Polar Surface Area: 53.72 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Classification: Rare Genuine Natural Compounds