2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine

C15H9N3S2 — CID 4638749

IUPAC2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine
SMILESc1csc(-c2nc3cccnc3nc2-c2cccs2)c1
InChIInChI=1S/C15H9N3S2/c1-4-10-15(16-7-1)18-14(12-6-3-9-20-12)13(17-10)11-5-2-8-19-11/h1-9H
InChIKeyDVFOTSWUXNMZFT-UHFFFAOYSA-N
MW295.39 g/mol
LogP4.48
Rot. Bonds2

About 2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine

2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine (PubChem CID 4638749) has the molecular formula C15H9N3S2 and a molecular weight of 295.39 g/mol. Its IUPAC name is 2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine
PubChem CID4638749
Molecular FormulaC15H9N3S2
Molecular Weight295.39 g/mol
Exact Mass295.02
IUPAC Name2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine
SMILESc1csc(-c2nc3cccnc3nc2-c2cccs2)c1
InChIInChI=1S/C15H9N3S2/c1-4-10-15(16-7-1)18-14(12-6-3-9-20-12)13(17-10)11-5-2-8-19-11/h1-9H
InChIKeyDVFOTSWUXNMZFT-UHFFFAOYSA-N
XLogP4.48
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine?
The IUPAC name of 2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine (CID 4638749) is 2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine.
What is the SMILES notation for 2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine?
The canonical SMILES for 2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine is c1csc(-c2nc3cccnc3nc2-c2cccs2)c1.
What is the InChIKey of 2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine?
The InChIKey is DVFOTSWUXNMZFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9N3S2/c1-4-10-15(16-7-1)18-14(12-6-3-9-20-12)13(17-10)11-5-2-8-19-11/h1-9H.
What are the key properties of 2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine?
2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine has a molecular weight of 295.39 g/mol, XLogP of 4.48, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dithiophen-2-ylpyrido[2,3-b]pyrazine is sourced from PubChem (CID 4638749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).