6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline

C15H10Br2N2O — CID 57420227

IUPAC6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline
SMILESCOc1nc2cc(Br)ccc2nc1-c1ccc(Br)cc1
InChIInChI=1S/C15H10Br2N2O/c1-20-15-14(9-2-4-10(16)5-3-9)18-12-7-6-11(17)8-13(12)19-15/h2-8H,1H3
InChIKeyJLNYWOLSPIMPPW-UHFFFAOYSA-N
MW394.07 g/mol
LogP4.83
Rot. Bonds2

About 6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline

6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline (PubChem CID 57420227) has the molecular formula C15H10Br2N2O and a molecular weight of 394.07 g/mol. Its IUPAC name is 6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline.

Molecular Properties

Compound Name6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline
PubChem CID57420227
Molecular FormulaC15H10Br2N2O
Molecular Weight394.07 g/mol
Exact Mass391.92
IUPAC Name6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline
SMILESCOc1nc2cc(Br)ccc2nc1-c1ccc(Br)cc1
InChIInChI=1S/C15H10Br2N2O/c1-20-15-14(9-2-4-10(16)5-3-9)18-12-7-6-11(17)8-13(12)19-15/h2-8H,1H3
InChIKeyJLNYWOLSPIMPPW-UHFFFAOYSA-N
XLogP4.83
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.07
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline?
The IUPAC name of 6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline (CID 57420227) is 6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline.
What is the SMILES notation for 6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline?
The canonical SMILES for 6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline is COc1nc2cc(Br)ccc2nc1-c1ccc(Br)cc1.
What is the InChIKey of 6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline?
The InChIKey is JLNYWOLSPIMPPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Br2N2O/c1-20-15-14(9-2-4-10(16)5-3-9)18-12-7-6-11(17)8-13(12)19-15/h2-8H,1H3.
What are the key properties of 6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline?
6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline has a molecular weight of 394.07 g/mol, XLogP of 4.83, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(4-bromophenyl)-3-methoxyquinoxaline is sourced from PubChem (CID 57420227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).