2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one

C14H9N3OS — CID 10355614

IUPAC2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one
SMILESO=c1[nH]c2ccccc2n2cc(-c3cccs3)nc12
InChIInChI=1S/C14H9N3OS/c18-14-13-15-10(12-6-3-7-19-12)8-17(13)11-5-2-1-4-9(11)16-14/h1-8H,(H,16,18)
InChIKeyOOSVEZPRHUDBLK-UHFFFAOYSA-N
MW267.31 g/mol
LogP2.90
Rot. Bonds1

About 2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one

2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one (PubChem CID 10355614) has the molecular formula C14H9N3OS and a molecular weight of 267.31 g/mol. Its IUPAC name is 2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one.

Molecular Properties

Compound Name2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one
PubChem CID10355614
Molecular FormulaC14H9N3OS
Molecular Weight267.31 g/mol
Exact Mass267.05
IUPAC Name2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one
SMILESO=c1[nH]c2ccccc2n2cc(-c3cccs3)nc12
InChIInChI=1S/C14H9N3OS/c18-14-13-15-10(12-6-3-7-19-12)8-17(13)11-5-2-1-4-9(11)16-14/h1-8H,(H,16,18)
InChIKeyOOSVEZPRHUDBLK-UHFFFAOYSA-N
XLogP2.90
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.31
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one?
The IUPAC name of 2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one (CID 10355614) is 2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one.
What is the SMILES notation for 2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one?
The canonical SMILES for 2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one is O=c1[nH]c2ccccc2n2cc(-c3cccs3)nc12.
What is the InChIKey of 2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one?
The InChIKey is OOSVEZPRHUDBLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9N3OS/c18-14-13-15-10(12-6-3-7-19-12)8-17(13)11-5-2-1-4-9(11)16-14/h1-8H,(H,16,18).
What are the key properties of 2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one?
2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one has a molecular weight of 267.31 g/mol, XLogP of 2.90, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-2-yl-5H-imidazo[1,2-a]quinoxalin-4-one is sourced from PubChem (CID 10355614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).