2-(4-methoxyphenyl)sulfonylquinoxaline

C15H12N2O3S — CID 4209634

IUPAC2-(4-methoxyphenyl)sulfonylquinoxaline
SMILESCOc1ccc(S(=O)(=O)c2cnc3ccccc3n2)cc1
InChIInChI=1S/C15H12N2O3S/c1-20-11-6-8-12(9-7-11)21(18,19)15-10-16-13-4-2-3-5-14(13)17-15/h2-10H,1H3
InChIKeyRGXQURWAQNHJPC-UHFFFAOYSA-N
MW300.34 g/mol
LogP2.47
Rot. Bonds3

About 2-(4-methoxyphenyl)sulfonylquinoxaline

2-(4-methoxyphenyl)sulfonylquinoxaline (PubChem CID 4209634) has the molecular formula C15H12N2O3S and a molecular weight of 300.34 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)sulfonylquinoxaline.

Molecular Properties

Compound Name2-(4-methoxyphenyl)sulfonylquinoxaline
PubChem CID4209634
Molecular FormulaC15H12N2O3S
Molecular Weight300.34 g/mol
Exact Mass300.06
IUPAC Name2-(4-methoxyphenyl)sulfonylquinoxaline
SMILESCOc1ccc(S(=O)(=O)c2cnc3ccccc3n2)cc1
InChIInChI=1S/C15H12N2O3S/c1-20-11-6-8-12(9-7-11)21(18,19)15-10-16-13-4-2-3-5-14(13)17-15/h2-10H,1H3
InChIKeyRGXQURWAQNHJPC-UHFFFAOYSA-N
XLogP2.47
TPSA69.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.34
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)sulfonylquinoxaline?
The IUPAC name of 2-(4-methoxyphenyl)sulfonylquinoxaline (CID 4209634) is 2-(4-methoxyphenyl)sulfonylquinoxaline.
What is the SMILES notation for 2-(4-methoxyphenyl)sulfonylquinoxaline?
The canonical SMILES for 2-(4-methoxyphenyl)sulfonylquinoxaline is COc1ccc(S(=O)(=O)c2cnc3ccccc3n2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)sulfonylquinoxaline?
The InChIKey is RGXQURWAQNHJPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O3S/c1-20-11-6-8-12(9-7-11)21(18,19)15-10-16-13-4-2-3-5-14(13)17-15/h2-10H,1H3.
What are the key properties of 2-(4-methoxyphenyl)sulfonylquinoxaline?
2-(4-methoxyphenyl)sulfonylquinoxaline has a molecular weight of 300.34 g/mol, XLogP of 2.47, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)sulfonylquinoxaline is sourced from PubChem (CID 4209634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).