2,3-bis(benzenesulfonyl)quinoxaline

C20H14N2O4S2 — CID 6612515

IUPAC2,3-bis(benzenesulfonyl)quinoxaline
SMILESO=S(=O)(c1ccccc1)c1nc2ccccc2nc1S(=O)(=O)c1ccccc1
InChIInChI=1S/C20H14N2O4S2/c23-27(24,15-9-3-1-4-10-15)19-20(22-18-14-8-7-13-17(18)21-19)28(25,26)16-11-5-2-6-12-16/h1-14H
InChIKeyUPKANSBPPJJXLC-UHFFFAOYSA-N
MW410.48 g/mol
LogP3.30
Rot. Bonds4

About 2,3-bis(benzenesulfonyl)quinoxaline

2,3-bis(benzenesulfonyl)quinoxaline (PubChem CID 6612515) has the molecular formula C20H14N2O4S2 and a molecular weight of 410.48 g/mol. Its IUPAC name is 2,3-bis(benzenesulfonyl)quinoxaline.

Molecular Properties

Compound Name2,3-bis(benzenesulfonyl)quinoxaline
PubChem CID6612515
Molecular FormulaC20H14N2O4S2
Molecular Weight410.48 g/mol
Exact Mass410.04
IUPAC Name2,3-bis(benzenesulfonyl)quinoxaline
SMILESO=S(=O)(c1ccccc1)c1nc2ccccc2nc1S(=O)(=O)c1ccccc1
InChIInChI=1S/C20H14N2O4S2/c23-27(24,15-9-3-1-4-10-15)19-20(22-18-14-8-7-13-17(18)21-19)28(25,26)16-11-5-2-6-12-16/h1-14H
InChIKeyUPKANSBPPJJXLC-UHFFFAOYSA-N
XLogP3.30
TPSA94.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.48
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,3-bis(benzenesulfonyl)quinoxaline?
The IUPAC name of 2,3-bis(benzenesulfonyl)quinoxaline (CID 6612515) is 2,3-bis(benzenesulfonyl)quinoxaline.
What is the SMILES notation for 2,3-bis(benzenesulfonyl)quinoxaline?
The canonical SMILES for 2,3-bis(benzenesulfonyl)quinoxaline is O=S(=O)(c1ccccc1)c1nc2ccccc2nc1S(=O)(=O)c1ccccc1.
What is the InChIKey of 2,3-bis(benzenesulfonyl)quinoxaline?
The InChIKey is UPKANSBPPJJXLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2O4S2/c23-27(24,15-9-3-1-4-10-15)19-20(22-18-14-8-7-13-17(18)21-19)28(25,26)16-11-5-2-6-12-16/h1-14H.
What are the key properties of 2,3-bis(benzenesulfonyl)quinoxaline?
2,3-bis(benzenesulfonyl)quinoxaline has a molecular weight of 410.48 g/mol, XLogP of 3.30, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(benzenesulfonyl)quinoxaline is sourced from PubChem (CID 6612515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).