2-methylimidazo[1,2-b]pyridazin-6-amine

• ChemBase ID: 291868
• Molecular Formular: C7H8N4
• Molecular Mass: 148.16522
• Monoisotopic Mass: 148.07489628
• SMILES: Cc1cn2nc(N)ccc2n1
• Canonical SMILES: Nc1ccc2n(n1)cc(n2)C
• InChI: InChI=1S/C7H8N4/c1-5-4-11-7(9-5)3-2-6(8)10-11/h2-4H,1H3,(H2,8,10)
• InChIKey: YGYLUBAECATVQW-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-methylimidazo[1,2-b]pyridazin-6-amine
• IUPAC Traditional name: 2-methylimidazo[1,2-b]pyridazin-6-amine
• Synonyms: 2-Methylimidazo[1,2-b]pyridazin-6-amine

Database IDs

• CAS Number: 154704-35-5
• MDL Number: MFCD19211982
• PubChem SID: 180677399
• PubChem CID: 10057651

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): 0.5108141
• LogD (pH = 7.4): 0.5493587
• Log P: 0.54987437
• Molar Refractivity: 53.379 cm^3
• Polarizability: 15.297633 Å^3
• Polar Surface Area: 56.21 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%