2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline

C12H6BrFN2S — CID 2727988

IUPAC2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline
SMILESFc1ccc2ncc(-c3ccc(Br)s3)nc2c1
InChIInChI=1S/C12H6BrFN2S/c13-12-4-3-11(17-12)10-6-15-8-2-1-7(14)5-9(8)16-10/h1-6H
InChIKeyAZAOQJQBSOWFJM-UHFFFAOYSA-N
MW309.16 g/mol
LogP4.26
Rot. Bonds1

About 2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline

2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline (PubChem CID 2727988) has the molecular formula C12H6BrFN2S and a molecular weight of 309.16 g/mol. Its IUPAC name is 2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline.

Molecular Properties

Compound Name2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline
PubChem CID2727988
Molecular FormulaC12H6BrFN2S
Molecular Weight309.16 g/mol
Exact Mass307.94
IUPAC Name2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline
SMILESFc1ccc2ncc(-c3ccc(Br)s3)nc2c1
InChIInChI=1S/C12H6BrFN2S/c13-12-4-3-11(17-12)10-6-15-8-2-1-7(14)5-9(8)16-10/h1-6H
InChIKeyAZAOQJQBSOWFJM-UHFFFAOYSA-N
XLogP4.26
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.16
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline?
The IUPAC name of 2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline (CID 2727988) is 2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline.
What is the SMILES notation for 2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline?
The canonical SMILES for 2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline is Fc1ccc2ncc(-c3ccc(Br)s3)nc2c1.
What is the InChIKey of 2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline?
The InChIKey is AZAOQJQBSOWFJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6BrFN2S/c13-12-4-3-11(17-12)10-6-15-8-2-1-7(14)5-9(8)16-10/h1-6H.
What are the key properties of 2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline?
2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline has a molecular weight of 309.16 g/mol, XLogP of 4.26, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromothiophen-2-yl)-7-fluoroquinoxaline is sourced from PubChem (CID 2727988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).