Thieno[2,3-c]pyridine, 7-(1-piperazinyl)-
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Basic information
- CAS
106261-29-4- Standard SMILES
c1cc2ccsc2c(N2CCNCC2)n1- InChIKey
FJGAJXIEIOCUFQ-UHFFFAOYSA-N- Molecular formula
- C11H13N3S
- Average molar mass
- 219.31 g/mol
- Monoisotopic mass
- 219.0830186
Names & identifiers
- Preferred name
- Thieno[2,3-c]pyridine, 7-(1-piperazinyl)-
- IUPAC
- 7-piperazin-1-ylthieno[2,3-c]pyridine
- English name
- 7-(Piperazin-1-yl)thieno[2,3-c]pyridine
- Molecular formula
- C11H13N3S
- Molecular weight
- 219.31
Names & synonyms
Thieno[2,3-c]pyridine, 7-(1-piperazinyl)-106261-29-47-piperazin-1-ylthieno[2,3-c]pyridine7-(Piperazin-1-yl)thieno[2,3-c]pyridineSCHEMBL613412DTXSID00593381CHEBI:192728PD0495891-{THIENO[2,3-C]PYRIDIN-7-YL}PIPERAZINE7-(1-Piperazinyl)thieno[2,3-c]pyridine
Database identifiers
- CAS
106261-29-4- PubChem CID
- 18399697
- DTXSID
DTXSID00593381- ChEBI
CHEBI:192728
Properties
Computed structural propertiesFilling in
- XLogP
- 1.7
- Topological polar surface area
- 56.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 218
Physicochemical properties
- Boiling point
- 422.2 · 422.2±35.0 °C(Predicted)
- Density
- 1.256 · 1.256±0.06 g/cm3(Predicted)
- pka
- 8.59 · 8.59±0.10(Predicted)
Chemistry & industry
Additional notes
DefinitionChEBI: Thieno[2,3-c]pyridine, 7-(1-piperazinyl)- is a member of pyridines and a member of piperazines.
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Related reactions
1 records
Compound notes
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