2-(2-chlorophenyl)sulfanylquinoxaline

C14H9ClN2S — CID 3740927

IUPAC2-(2-chlorophenyl)sulfanylquinoxaline
SMILESClc1ccccc1Sc1cnc2ccccc2n1
InChIInChI=1S/C14H9ClN2S/c15-10-5-1-4-8-13(10)18-14-9-16-11-6-2-3-7-12(11)17-14/h1-9H
InChIKeyVPICYQMLAJLTFJ-UHFFFAOYSA-N
MW272.76 g/mol
LogP4.43
Rot. Bonds2

About 2-(2-chlorophenyl)sulfanylquinoxaline

2-(2-chlorophenyl)sulfanylquinoxaline (PubChem CID 3740927) has the molecular formula C14H9ClN2S and a molecular weight of 272.76 g/mol. Its IUPAC name is 2-(2-chlorophenyl)sulfanylquinoxaline.

Molecular Properties

Compound Name2-(2-chlorophenyl)sulfanylquinoxaline
PubChem CID3740927
Molecular FormulaC14H9ClN2S
Molecular Weight272.76 g/mol
Exact Mass272.02
IUPAC Name2-(2-chlorophenyl)sulfanylquinoxaline
SMILESClc1ccccc1Sc1cnc2ccccc2n1
InChIInChI=1S/C14H9ClN2S/c15-10-5-1-4-8-13(10)18-14-9-16-11-6-2-3-7-12(11)17-14/h1-9H
InChIKeyVPICYQMLAJLTFJ-UHFFFAOYSA-N
XLogP4.43
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.76
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)sulfanylquinoxaline?
The IUPAC name of 2-(2-chlorophenyl)sulfanylquinoxaline (CID 3740927) is 2-(2-chlorophenyl)sulfanylquinoxaline.
What is the SMILES notation for 2-(2-chlorophenyl)sulfanylquinoxaline?
The canonical SMILES for 2-(2-chlorophenyl)sulfanylquinoxaline is Clc1ccccc1Sc1cnc2ccccc2n1.
What is the InChIKey of 2-(2-chlorophenyl)sulfanylquinoxaline?
The InChIKey is VPICYQMLAJLTFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClN2S/c15-10-5-1-4-8-13(10)18-14-9-16-11-6-2-3-7-12(11)17-14/h1-9H.
What are the key properties of 2-(2-chlorophenyl)sulfanylquinoxaline?
2-(2-chlorophenyl)sulfanylquinoxaline has a molecular weight of 272.76 g/mol, XLogP of 4.43, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)sulfanylquinoxaline is sourced from PubChem (CID 3740927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).