2,3-bis(3-phenylphenyl)quinoxaline

C32H22N2 — CID 154589163

IUPAC2,3-bis(3-phenylphenyl)quinoxaline
SMILESc1ccc(-c2cccc(-c3nc4ccccc4nc3-c3cccc(-c4ccccc4)c3)c2)cc1
InChIInChI=1S/C32H22N2/c1-3-11-23(12-4-1)25-15-9-17-27(21-25)31-32(34-30-20-8-7-19-29(30)33-31)28-18-10-16-26(22-28)24-13-5-2-6-14-24/h1-22H
InChIKeyWYOOODHZXGMGMA-UHFFFAOYSA-N
MW434.54 g/mol
LogP8.30
Rot. Bonds4

About 2,3-bis(3-phenylphenyl)quinoxaline

2,3-bis(3-phenylphenyl)quinoxaline (PubChem CID 154589163) has the molecular formula C32H22N2 and a molecular weight of 434.54 g/mol. Its IUPAC name is 2,3-bis(3-phenylphenyl)quinoxaline.

Molecular Properties

Compound Name2,3-bis(3-phenylphenyl)quinoxaline
PubChem CID154589163
Molecular FormulaC32H22N2
Molecular Weight434.54 g/mol
Exact Mass434.18
IUPAC Name2,3-bis(3-phenylphenyl)quinoxaline
SMILESc1ccc(-c2cccc(-c3nc4ccccc4nc3-c3cccc(-c4ccccc4)c3)c2)cc1
InChIInChI=1S/C32H22N2/c1-3-11-23(12-4-1)25-15-9-17-27(21-25)31-32(34-30-20-8-7-19-29(30)33-31)28-18-10-16-26(22-28)24-13-5-2-6-14-24/h1-22H
InChIKeyWYOOODHZXGMGMA-UHFFFAOYSA-N
XLogP8.30
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms34
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500434.54
LogP ≤ 58.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-bis(3-phenylphenyl)quinoxaline?
The IUPAC name of 2,3-bis(3-phenylphenyl)quinoxaline (CID 154589163) is 2,3-bis(3-phenylphenyl)quinoxaline.
What is the SMILES notation for 2,3-bis(3-phenylphenyl)quinoxaline?
The canonical SMILES for 2,3-bis(3-phenylphenyl)quinoxaline is c1ccc(-c2cccc(-c3nc4ccccc4nc3-c3cccc(-c4ccccc4)c3)c2)cc1.
What is the InChIKey of 2,3-bis(3-phenylphenyl)quinoxaline?
The InChIKey is WYOOODHZXGMGMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H22N2/c1-3-11-23(12-4-1)25-15-9-17-27(21-25)31-32(34-30-20-8-7-19-29(30)33-31)28-18-10-16-26(22-28)24-13-5-2-6-14-24/h1-22H.
What are the key properties of 2,3-bis(3-phenylphenyl)quinoxaline?
2,3-bis(3-phenylphenyl)quinoxaline has a molecular weight of 434.54 g/mol, XLogP of 8.30, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(3-phenylphenyl)quinoxaline is sourced from PubChem (CID 154589163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).