imidazo[1,2-a]pyrazin-8-amine

• ChemBase ID: 272066
• Molecular Formular: C6H6N4
• Molecular Mass: 134.13864
• Monoisotopic Mass: 134.05924621
• SMILES: c12n(ccn2)ccnc1N
• Canonical SMILES: Nc1nccn2c1ncc2
• InChI: InChI=1S/C6H6N4/c7-5-6-9-2-4-10(6)3-1-8-5/h1-4H,(H2,7,8)
• InChIKey: RZLXZEJRGRNLQR-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: imidazo[1,2-a]pyrazin-8-amine
• IUPAC Traditional name: imidazo[1,2-a]pyrazin-8-amine
• Synonyms: imidazo[1,2-a]pyrazin-8-amine

Database IDs

• MDL Number: MFCD09835034
• PubChem SID: 164327976
• PubChem CID: 10261137

CALCULATED PROPERTIES

• Acid pKa: 18.268608
• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -0.70622337
• LogD (pH = 7.4): -0.69276625
• Log P: -0.6925914
• Molar Refractivity: 38.7934 cm^3
• Polarizability: 13.548022 Å^3
• Polar Surface Area: 56.21 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 212 - 214°C
• Hydrophobicity(logP): 0.208

Product Information

• Purity: 95%