Basic information
- CAS
607696-62-8- Standard SMILES
CC(=O)c1sc2nc(-c3ccco3)ccc2c1N- InChIKey
XOKDKVMZWSGZTD-UHFFFAOYSA-N- Molecular formula
- C13H10N2O2S
- Average molar mass
- 258.3 g/mol
- Monoisotopic mass
- 258.04629874
Names & identifiers
- Preferred name
- 1-[3-Amino-6-(furan-2-yl)thieno[2,3-b]pyridin-2-yl]ethanone
- IUPAC
- 1-[3-amino-6-(furan-2-yl)thieno[2,3-b]pyridin-2-yl]ethanone
Names & synonyms
1-[3-amino-6-(furan-2-yl)thieno[2,3-b]pyridin-2-yl]ethanoneMLS000763131607696-62-8SMR0004395601-(3-Amino-6-furan-2-yl-thieno[2,3-b]pyridin-2-yl)-ethanone1-(3-Amino-6-(furan-2-yl)thieno[2,3-b]pyridin-2-yl)ethan-1-one1-(3-amino-6-(furan-2-yl)thieno[2,3-b]pyridin-2-yl)ethanone1-[3-Amino-6-(furan-2-yl)thieno[2,3-b]pyridin-2-yl]ethan-1-onecid_930267CHEMBL1424878BDBM50630DTXSID801320655
Show more names
HMS2779A18STK788696AKOS002693715BRD-K00131920-001-08-81-[3-amino-6-(2-furanyl)-2-thieno[2,3-b]pyridinyl]ethanone1-[3-amino-6-(2-furyl)thieno[2,3-b]pyridin-2-yl]ethanone1-[3-azanyl-6-(furan-2-yl)thieno[2,3-b]pyridin-2-yl]ethanone
Database identifiers
- CAS
607696-62-8- PubChem CID
- 930267
- DTXSID
DTXSID801320655- ChEMBL
CHEMBL1424878
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 97.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 339
Experimental & physicochemical properties
Solubility6 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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