6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline

C12H9FN2S — CID 130209544

IUPAC6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline
SMILESCc1cc(F)c(C)c2nc3cscc3nc12
InChIInChI=1S/C12H9FN2S/c1-6-3-8(13)7(2)12-11(6)14-9-4-16-5-10(9)15-12/h3-5H,1-2H3
InChIKeyWLKUOZBBBADIDU-UHFFFAOYSA-N
MW232.28 g/mol
LogP3.60
Rot. Bonds

About 6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline

6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline (PubChem CID 130209544) has the molecular formula C12H9FN2S and a molecular weight of 232.28 g/mol. Its IUPAC name is 6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline.

Molecular Properties

Compound Name6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline
PubChem CID130209544
Molecular FormulaC12H9FN2S
Molecular Weight232.28 g/mol
Exact Mass232.05
IUPAC Name6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline
SMILESCc1cc(F)c(C)c2nc3cscc3nc12
InChIInChI=1S/C12H9FN2S/c1-6-3-8(13)7(2)12-11(6)14-9-4-16-5-10(9)15-12/h3-5H,1-2H3
InChIKeyWLKUOZBBBADIDU-UHFFFAOYSA-N
XLogP3.60
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline?
The IUPAC name of 6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline (CID 130209544) is 6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline.
What is the SMILES notation for 6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline?
The canonical SMILES for 6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline is Cc1cc(F)c(C)c2nc3cscc3nc12.
What is the InChIKey of 6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline?
The InChIKey is WLKUOZBBBADIDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9FN2S/c1-6-3-8(13)7(2)12-11(6)14-9-4-16-5-10(9)15-12/h3-5H,1-2H3.
What are the key properties of 6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline?
6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline has a molecular weight of 232.28 g/mol, XLogP of 3.60, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-5,8-dimethylthieno[3,4-b]quinoxaline is sourced from PubChem (CID 130209544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).