2,3-bis(4-bromophenyl)pyrazine

C16H10Br2N2 — CID 13171295

IUPAC2,3-bis(4-bromophenyl)pyrazine
SMILESBrc1ccc(-c2nccnc2-c2ccc(Br)cc2)cc1
InChIInChI=1S/C16H10Br2N2/c17-13-5-1-11(2-6-13)15-16(20-10-9-19-15)12-3-7-14(18)8-4-12/h1-10H
InChIKeyIFYVQILXLCDBEO-UHFFFAOYSA-N
MW390.08 g/mol
LogP5.34
Rot. Bonds2

About 2,3-bis(4-bromophenyl)pyrazine

2,3-bis(4-bromophenyl)pyrazine (PubChem CID 13171295) has the molecular formula C16H10Br2N2 and a molecular weight of 390.08 g/mol. Its IUPAC name is 2,3-bis(4-bromophenyl)pyrazine.

Molecular Properties

Compound Name2,3-bis(4-bromophenyl)pyrazine
PubChem CID13171295
Molecular FormulaC16H10Br2N2
Molecular Weight390.08 g/mol
Exact Mass387.92
IUPAC Name2,3-bis(4-bromophenyl)pyrazine
SMILESBrc1ccc(-c2nccnc2-c2ccc(Br)cc2)cc1
InChIInChI=1S/C16H10Br2N2/c17-13-5-1-11(2-6-13)15-16(20-10-9-19-15)12-3-7-14(18)8-4-12/h1-10H
InChIKeyIFYVQILXLCDBEO-UHFFFAOYSA-N
XLogP5.34
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.08
LogP ≤ 55.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-bis(4-bromophenyl)pyrazine?
The IUPAC name of 2,3-bis(4-bromophenyl)pyrazine (CID 13171295) is 2,3-bis(4-bromophenyl)pyrazine.
What is the SMILES notation for 2,3-bis(4-bromophenyl)pyrazine?
The canonical SMILES for 2,3-bis(4-bromophenyl)pyrazine is Brc1ccc(-c2nccnc2-c2ccc(Br)cc2)cc1.
What is the InChIKey of 2,3-bis(4-bromophenyl)pyrazine?
The InChIKey is IFYVQILXLCDBEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Br2N2/c17-13-5-1-11(2-6-13)15-16(20-10-9-19-15)12-3-7-14(18)8-4-12/h1-10H.
What are the key properties of 2,3-bis(4-bromophenyl)pyrazine?
2,3-bis(4-bromophenyl)pyrazine has a molecular weight of 390.08 g/mol, XLogP of 5.34, 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)pyrazine is sourced from PubChem (CID 13171295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).