2-methyl-3-phenylsulfanylquinoxaline

C15H12N2S — CID 899293

IUPAC2-methyl-3-phenylsulfanylquinoxaline
SMILESCc1nc2ccccc2nc1Sc1ccccc1
InChIInChI=1S/C15H12N2S/c1-11-15(18-12-7-3-2-4-8-12)17-14-10-6-5-9-13(14)16-11/h2-10H,1H3
InChIKeyIIJHZXBNDCORDG-UHFFFAOYSA-N
MW252.34 g/mol
LogP4.09
Rot. Bonds2

About 2-methyl-3-phenylsulfanylquinoxaline

2-methyl-3-phenylsulfanylquinoxaline (PubChem CID 899293) has the molecular formula C15H12N2S and a molecular weight of 252.34 g/mol. Its IUPAC name is 2-methyl-3-phenylsulfanylquinoxaline.

Molecular Properties

Compound Name2-methyl-3-phenylsulfanylquinoxaline
PubChem CID899293
Molecular FormulaC15H12N2S
Molecular Weight252.34 g/mol
Exact Mass252.07
IUPAC Name2-methyl-3-phenylsulfanylquinoxaline
SMILESCc1nc2ccccc2nc1Sc1ccccc1
InChIInChI=1S/C15H12N2S/c1-11-15(18-12-7-3-2-4-8-12)17-14-10-6-5-9-13(14)16-11/h2-10H,1H3
InChIKeyIIJHZXBNDCORDG-UHFFFAOYSA-N
XLogP4.09
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.34
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-phenylsulfanylquinoxaline?
The IUPAC name of 2-methyl-3-phenylsulfanylquinoxaline (CID 899293) is 2-methyl-3-phenylsulfanylquinoxaline.
What is the SMILES notation for 2-methyl-3-phenylsulfanylquinoxaline?
The canonical SMILES for 2-methyl-3-phenylsulfanylquinoxaline is Cc1nc2ccccc2nc1Sc1ccccc1.
What is the InChIKey of 2-methyl-3-phenylsulfanylquinoxaline?
The InChIKey is IIJHZXBNDCORDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2S/c1-11-15(18-12-7-3-2-4-8-12)17-14-10-6-5-9-13(14)16-11/h2-10H,1H3.
What are the key properties of 2-methyl-3-phenylsulfanylquinoxaline?
2-methyl-3-phenylsulfanylquinoxaline has a molecular weight of 252.34 g/mol, XLogP of 4.09, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-phenylsulfanylquinoxaline is sourced from PubChem (CID 899293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).