6-methyl-2,3-bis(methylsulfanyl)quinoxaline

C11H12N2S2 — CID 139445231

IUPAC6-methyl-2,3-bis(methylsulfanyl)quinoxaline
SMILESCSc1nc2ccc(C)cc2nc1SC
InChIInChI=1S/C11H12N2S2/c1-7-4-5-8-9(6-7)13-11(15-3)10(12-8)14-2/h4-6H,1-3H3
InChIKeyAQROBEOMCRNXGI-UHFFFAOYSA-N
MW236.37 g/mol
LogP3.38
Rot. Bonds2

About 6-methyl-2,3-bis(methylsulfanyl)quinoxaline

6-methyl-2,3-bis(methylsulfanyl)quinoxaline (PubChem CID 139445231) has the molecular formula C11H12N2S2 and a molecular weight of 236.37 g/mol. Its IUPAC name is 6-methyl-2,3-bis(methylsulfanyl)quinoxaline.

Molecular Properties

Compound Name6-methyl-2,3-bis(methylsulfanyl)quinoxaline
PubChem CID139445231
Molecular FormulaC11H12N2S2
Molecular Weight236.37 g/mol
Exact Mass236.04
IUPAC Name6-methyl-2,3-bis(methylsulfanyl)quinoxaline
SMILESCSc1nc2ccc(C)cc2nc1SC
InChIInChI=1S/C11H12N2S2/c1-7-4-5-8-9(6-7)13-11(15-3)10(12-8)14-2/h4-6H,1-3H3
InChIKeyAQROBEOMCRNXGI-UHFFFAOYSA-N
XLogP3.38
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.37
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-methyl-2,3-bis(methylsulfanyl)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-methyl-2,3-bis(methylsulfanyl)quinoxaline?
The IUPAC name of 6-methyl-2,3-bis(methylsulfanyl)quinoxaline (CID 139445231) is 6-methyl-2,3-bis(methylsulfanyl)quinoxaline.
What is the SMILES notation for 6-methyl-2,3-bis(methylsulfanyl)quinoxaline?
The canonical SMILES for 6-methyl-2,3-bis(methylsulfanyl)quinoxaline is CSc1nc2ccc(C)cc2nc1SC.
What is the InChIKey of 6-methyl-2,3-bis(methylsulfanyl)quinoxaline?
The InChIKey is AQROBEOMCRNXGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2S2/c1-7-4-5-8-9(6-7)13-11(15-3)10(12-8)14-2/h4-6H,1-3H3.
What are the key properties of 6-methyl-2,3-bis(methylsulfanyl)quinoxaline?
6-methyl-2,3-bis(methylsulfanyl)quinoxaline has a molecular weight of 236.37 g/mol, XLogP of 3.38, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2,3-bis(methylsulfanyl)quinoxaline is sourced from PubChem (CID 139445231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).