5,6-bis(4-bromophenyl)-2,3-dihydropyrazine

C16H12Br2N2 — CID 13171290

IUPAC5,6-bis(4-bromophenyl)-2,3-dihydropyrazine
SMILESBrc1ccc(C2=NCCN=C2c2ccc(Br)cc2)cc1
InChIInChI=1S/C16H12Br2N2/c17-13-5-1-11(2-6-13)15-16(20-10-9-19-15)12-3-7-14(18)8-4-12/h1-8H,9-10H2
InChIKeyUHCFRAFFSZNHIA-UHFFFAOYSA-N
MW392.09 g/mol
LogP4.50
Rot. Bonds2

About 5,6-bis(4-bromophenyl)-2,3-dihydropyrazine

5,6-bis(4-bromophenyl)-2,3-dihydropyrazine (PubChem CID 13171290) has the molecular formula C16H12Br2N2 and a molecular weight of 392.09 g/mol. Its IUPAC name is 5,6-bis(4-bromophenyl)-2,3-dihydropyrazine.

Molecular Properties

Compound Name5,6-bis(4-bromophenyl)-2,3-dihydropyrazine
PubChem CID13171290
Molecular FormulaC16H12Br2N2
Molecular Weight392.09 g/mol
Exact Mass389.94
IUPAC Name5,6-bis(4-bromophenyl)-2,3-dihydropyrazine
SMILESBrc1ccc(C2=NCCN=C2c2ccc(Br)cc2)cc1
InChIInChI=1S/C16H12Br2N2/c17-13-5-1-11(2-6-13)15-16(20-10-9-19-15)12-3-7-14(18)8-4-12/h1-8H,9-10H2
InChIKeyUHCFRAFFSZNHIA-UHFFFAOYSA-N
XLogP4.50
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.09
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,6-bis(4-bromophenyl)-2,3-dihydropyrazine?
The IUPAC name of 5,6-bis(4-bromophenyl)-2,3-dihydropyrazine (CID 13171290) is 5,6-bis(4-bromophenyl)-2,3-dihydropyrazine.
What is the SMILES notation for 5,6-bis(4-bromophenyl)-2,3-dihydropyrazine?
The canonical SMILES for 5,6-bis(4-bromophenyl)-2,3-dihydropyrazine is Brc1ccc(C2=NCCN=C2c2ccc(Br)cc2)cc1.
What is the InChIKey of 5,6-bis(4-bromophenyl)-2,3-dihydropyrazine?
The InChIKey is UHCFRAFFSZNHIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12Br2N2/c17-13-5-1-11(2-6-13)15-16(20-10-9-19-15)12-3-7-14(18)8-4-12/h1-8H,9-10H2.
What are the key properties of 5,6-bis(4-bromophenyl)-2,3-dihydropyrazine?
5,6-bis(4-bromophenyl)-2,3-dihydropyrazine has a molecular weight of 392.09 g/mol, XLogP of 4.50, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-bis(4-bromophenyl)-2,3-dihydropyrazine is sourced from PubChem (CID 13171290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).