3,6-dichloro-2-methylsulfinylquinoxaline

C9H6Cl2N2OS — CID 118726438

IUPAC3,6-dichloro-2-methylsulfinylquinoxaline
SMILESCS(=O)c1nc2ccc(Cl)cc2nc1Cl
InChIInChI=1S/C9H6Cl2N2OS/c1-15(14)9-8(11)12-7-4-5(10)2-3-6(7)13-9/h2-4H,1H3
InChIKeyIPFYIXLGLKXTTQ-UHFFFAOYSA-N
MW261.13 g/mol
LogP2.67
Rot. Bonds1

About 3,6-dichloro-2-methylsulfinylquinoxaline

3,6-dichloro-2-methylsulfinylquinoxaline (PubChem CID 118726438) has the molecular formula C9H6Cl2N2OS and a molecular weight of 261.13 g/mol. Its IUPAC name is 3,6-dichloro-2-methylsulfinylquinoxaline.

Molecular Properties

Compound Name3,6-dichloro-2-methylsulfinylquinoxaline
PubChem CID118726438
Molecular FormulaC9H6Cl2N2OS
Molecular Weight261.13 g/mol
Exact Mass259.96
IUPAC Name3,6-dichloro-2-methylsulfinylquinoxaline
SMILESCS(=O)c1nc2ccc(Cl)cc2nc1Cl
InChIInChI=1S/C9H6Cl2N2OS/c1-15(14)9-8(11)12-7-4-5(10)2-3-6(7)13-9/h2-4H,1H3
InChIKeyIPFYIXLGLKXTTQ-UHFFFAOYSA-N
XLogP2.67
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.13
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3,6-dichloro-2-methylsulfinylquinoxaline with MolForge

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

Launch Full Analysis

Related Compounds

2,3,6-Trichloroquinoxaline
CID 18070
6-Chloro-2,3-dimethylquinoxaline
CID 236280
2-Chloro-3-methylsulfonylquinoxaline
CID 16731939
3,6-Dichloro-2-methylsulfonylquinoxaline
CID 16732511
6,7-Dichloro-2-methanesulfonyl-3-trifluoromethylquinoxaline
CID 9862981
6,7-Dichloro-2-(isopropylthio)-3-(methylsulfonyl)quinoxaline
CID 22341065
6,7-Dichloro-2-(methylsulfonyl)-3-propylquinoxaline
CID 22341131
6,7-Dichloro-2-isopropyl-3-(methylsulfonyl)quinoxaline
CID 22341206
6,7-Dichloro-3-(methylsulfonyl)quinoxalin-2-amine
CID 22341203
6,7-Dichloro-2-isopropyl-3-(methylsulfinyl)quinoxaline
CID 22341205
3,6-Dichloro-2-methylsulfanylquinoxaline
CID 86055868
3-Chloro-2-(methylthio)quinoxaline
CID 90442310

Frequently Asked Questions

What is the IUPAC name of 3,6-dichloro-2-methylsulfinylquinoxaline?
The IUPAC name of 3,6-dichloro-2-methylsulfinylquinoxaline (CID 118726438) is 3,6-dichloro-2-methylsulfinylquinoxaline.
What is the SMILES notation for 3,6-dichloro-2-methylsulfinylquinoxaline?
The canonical SMILES for 3,6-dichloro-2-methylsulfinylquinoxaline is CS(=O)c1nc2ccc(Cl)cc2nc1Cl.
What is the InChIKey of 3,6-dichloro-2-methylsulfinylquinoxaline?
The InChIKey is IPFYIXLGLKXTTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6Cl2N2OS/c1-15(14)9-8(11)12-7-4-5(10)2-3-6(7)13-9/h2-4H,1H3.
What are the key properties of 3,6-dichloro-2-methylsulfinylquinoxaline?
3,6-dichloro-2-methylsulfinylquinoxaline has a molecular weight of 261.13 g/mol, XLogP of 2.67, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dichloro-2-methylsulfinylquinoxaline is sourced from PubChem (CID 118726438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).