7-(4-methoxy-2-methylphenyl)pyrazolo[1,5-a]pyridine

• ChemBase ID: 379241
• Molecular Formular: C15H14N2O
• Molecular Mass: 238.28446
• Monoisotopic Mass: 238.11061308
• SMILES: n12c(c3c(cc(cc3)OC)C)cccc1ccn2
• Canonical SMILES: COc1ccc(c(c1)C)c1cccc2n1ncc2
• InChI: InChI=1S/C15H14N2O/c1-11-10-13(18-2)6-7-14(11)15-5-3-4-12-8-9-16-17(12)15/h3-10H,1-2H3
• InChIKey: FDQIJKMZOVEREA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 7-(4-methoxy-2-methylphenyl)pyrazolo[1,5-a]pyridine
• IUPAC Traditional name: 7-(4-methoxy-2-methylphenyl)pyrazolo[1,5-a]pyridine
• Synonyms: 7-(4-methoxy-2-methylphenyl)pyrazolo[1,5-a]pyridine

CALCULATED PROPERTIES

JChem

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 3.426066
• LogD (pH = 7.4): 3.4261584
• Log P: 3.4261596
• Molar Refractivity: 82.496 cm^3
• Polarizability: 29.258724 Å^3
• Polar Surface Area: 26.53 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

供应商提供(Chembridge)

• H Acceptors: 2
• H Donor: 0
• Log P: 3.71
• LOG S: -4.11
• Polar Surface Area: 26.53 Å^2
• Rotatable Bonds: 2