2-(3-Thienylmethoxy)-6-(1-Piperazinyl)Pyrazine

HCID 9878696

Notes Reactions

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Basic information

Standard SMILES: c1cc(COc2cncc(N3CCNCC3)n2)cs1
InChIKey: QUOYSAHPSMJRSS-UHFFFAOYSA-N
Molecular formula: C13H16N4OS
Average molar mass: 276.36 g/mol

Names & identifiers

Preferred name: 2-(3-Thienylmethoxy)-6-(1-Piperazinyl)Pyrazine
IUPAC: 2-piperazin-1-yl-6-(thiophen-3-ylmethoxy)pyrazine

Names & synonyms

SCHEMBL905984QUOYSAHPSMJRSS-UHFFFAOYSA-NDB-3755442-(1-Piperazinyl)-6-(3-thienylmethoxy)pyrazine2-(3-Thienylmethoxy)-6-(1-Piperazinyl)Pyrazine426832-37-3

Database identifiers

PubChem CID: 9878696

Properties

Computed structural properties

XLogP: 1.1
Topological polar surface area: 78.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 4
Heavy atoms: 19
Formal charge: 0
Complexity: 275

Related reactions

3 records

New reaction record

HRID 689194As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

HRID 1296675As productuspto-grants-2007_07

HRID 1357639As productuspto-grants-2003_07

Compound notes

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