5-bromo-6-chloroimidazo[1,5-a]pyrazine

C6H3BrClN3 — CID 118649582

IUPAC5-bromo-6-chloroimidazo[1,5-a]pyrazine
SMILESClc1ncc2cncn2c1Br
InChIInChI=1S/C6H3BrClN3/c7-5-6(8)10-2-4-1-9-3-11(4)5/h1-3H
InChIKeyISNHXHDHSQOPBY-UHFFFAOYSA-N
MW232.47 g/mol
LogP2.15
Rot. Bonds

About 5-bromo-6-chloroimidazo[1,5-a]pyrazine

5-bromo-6-chloroimidazo[1,5-a]pyrazine (PubChem CID 118649582) has the molecular formula C6H3BrClN3 and a molecular weight of 232.47 g/mol. Its IUPAC name is 5-bromo-6-chloroimidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name5-bromo-6-chloroimidazo[1,5-a]pyrazine
PubChem CID118649582
Molecular FormulaC6H3BrClN3
Molecular Weight232.47 g/mol
Exact Mass230.92
IUPAC Name5-bromo-6-chloroimidazo[1,5-a]pyrazine
SMILESClc1ncc2cncn2c1Br
InChIInChI=1S/C6H3BrClN3/c7-5-6(8)10-2-4-1-9-3-11(4)5/h1-3H
InChIKeyISNHXHDHSQOPBY-UHFFFAOYSA-N
XLogP2.15
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.47
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-chloroimidazo[1,5-a]pyrazine?
The IUPAC name of 5-bromo-6-chloroimidazo[1,5-a]pyrazine (CID 118649582) is 5-bromo-6-chloroimidazo[1,5-a]pyrazine.
What is the SMILES notation for 5-bromo-6-chloroimidazo[1,5-a]pyrazine?
The canonical SMILES for 5-bromo-6-chloroimidazo[1,5-a]pyrazine is Clc1ncc2cncn2c1Br.
What is the InChIKey of 5-bromo-6-chloroimidazo[1,5-a]pyrazine?
The InChIKey is ISNHXHDHSQOPBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3BrClN3/c7-5-6(8)10-2-4-1-9-3-11(4)5/h1-3H.
What are the key properties of 5-bromo-6-chloroimidazo[1,5-a]pyrazine?
5-bromo-6-chloroimidazo[1,5-a]pyrazine has a molecular weight of 232.47 g/mol, XLogP of 2.15, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-chloroimidazo[1,5-a]pyrazine is sourced from PubChem (CID 118649582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).