thieno[3,2-b]pyridin-6-amine

• ChemBase ID: 275176
• Molecular Formular: C7H6N2S
• Molecular Mass: 150.20094
• Monoisotopic Mass: 150.0251692
• SMILES: n1c2c(scc2)cc(c1)N
• Canonical SMILES: Nc1cnc2c(c1)scc2
• InChI: InChI=1S/C7H6N2S/c8-5-3-7-6(9-4-5)1-2-10-7/h1-4H,8H2
• InChIKey: ZEPHVTQYZYJBCT-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: thieno[3,2-b]pyridin-6-amine
• IUPAC Traditional name: thieno[3,2-b]pyridin-6-amine
• Synonyms: thieno[3,2-b]pyridin-6-amine

Database IDs

• MDL Number: MFCD14706796
• PubChem SID: 164331086
• PubChem CID: 20148553

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 1.1824315
• LogD (pH = 7.4): 1.1884453
• Log P: 1.1885226
• Molar Refractivity: 41.5696 cm^3
• Polarizability: 16.737206 Å^3
• Polar Surface Area: 38.91 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.757

Product Information

• Purity: 95%