2,3-bis(4-bromophenyl)benzo[g]quinoxaline

C24H14Br2N2 — CID 70165676

IUPAC2,3-bis(4-bromophenyl)benzo[g]quinoxaline
SMILESBrc1ccc(-c2nc3cc4ccccc4cc3nc2-c2ccc(Br)cc2)cc1
InChIInChI=1S/C24H14Br2N2/c25-19-9-5-15(6-10-19)23-24(16-7-11-20(26)12-8-16)28-22-14-18-4-2-1-3-17(18)13-21(22)27-23/h1-14H
InChIKeyCCNBWBOBQINVPB-UHFFFAOYSA-N
MW490.20 g/mol
LogP7.64
Rot. Bonds2

About 2,3-bis(4-bromophenyl)benzo[g]quinoxaline

2,3-bis(4-bromophenyl)benzo[g]quinoxaline (PubChem CID 70165676) has the molecular formula C24H14Br2N2 and a molecular weight of 490.20 g/mol. Its IUPAC name is 2,3-bis(4-bromophenyl)benzo[g]quinoxaline.

Molecular Properties

Compound Name2,3-bis(4-bromophenyl)benzo[g]quinoxaline
PubChem CID70165676
Molecular FormulaC24H14Br2N2
Molecular Weight490.20 g/mol
Exact Mass487.95
IUPAC Name2,3-bis(4-bromophenyl)benzo[g]quinoxaline
SMILESBrc1ccc(-c2nc3cc4ccccc4cc3nc2-c2ccc(Br)cc2)cc1
InChIInChI=1S/C24H14Br2N2/c25-19-9-5-15(6-10-19)23-24(16-7-11-20(26)12-8-16)28-22-14-18-4-2-1-3-17(18)13-21(22)27-23/h1-14H
InChIKeyCCNBWBOBQINVPB-UHFFFAOYSA-N
XLogP7.64
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500490.20
LogP ≤ 57.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,3-bis(4-bromophenyl)benzo[g]quinoxaline?
The IUPAC name of 2,3-bis(4-bromophenyl)benzo[g]quinoxaline (CID 70165676) is 2,3-bis(4-bromophenyl)benzo[g]quinoxaline.
What is the SMILES notation for 2,3-bis(4-bromophenyl)benzo[g]quinoxaline?
The canonical SMILES for 2,3-bis(4-bromophenyl)benzo[g]quinoxaline is Brc1ccc(-c2nc3cc4ccccc4cc3nc2-c2ccc(Br)cc2)cc1.
What is the InChIKey of 2,3-bis(4-bromophenyl)benzo[g]quinoxaline?
The InChIKey is CCNBWBOBQINVPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H14Br2N2/c25-19-9-5-15(6-10-19)23-24(16-7-11-20(26)12-8-16)28-22-14-18-4-2-1-3-17(18)13-21(22)27-23/h1-14H.
What are the key properties of 2,3-bis(4-bromophenyl)benzo[g]quinoxaline?
2,3-bis(4-bromophenyl)benzo[g]quinoxaline has a molecular weight of 490.20 g/mol, XLogP of 7.64, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(4-bromophenyl)benzo[g]quinoxaline is sourced from PubChem (CID 70165676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).