3-bromo-6-chloroimidazo[1,2-b]pyridazine

C6H3BrClN3 — CID 12872323

IUPAC3-bromo-6-chloroimidazo[1,2-b]pyridazine
SMILESClc1ccc2ncc(Br)n2n1
InChIInChI=1S/C6H3BrClN3/c7-4-3-9-6-2-1-5(8)10-11(4)6/h1-3H
InChIKeyPFHPKMPWBFJZEY-UHFFFAOYSA-N
MW232.47 g/mol
LogP2.15
Rot. Bonds

About 3-bromo-6-chloroimidazo[1,2-b]pyridazine

3-bromo-6-chloroimidazo[1,2-b]pyridazine (PubChem CID 12872323) has the molecular formula C6H3BrClN3 and a molecular weight of 232.47 g/mol. Its IUPAC name is 3-bromo-6-chloroimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name3-bromo-6-chloroimidazo[1,2-b]pyridazine
PubChem CID12872323
Molecular FormulaC6H3BrClN3
Molecular Weight232.47 g/mol
Exact Mass230.92
IUPAC Name3-bromo-6-chloroimidazo[1,2-b]pyridazine
SMILESClc1ccc2ncc(Br)n2n1
InChIInChI=1S/C6H3BrClN3/c7-4-3-9-6-2-1-5(8)10-11(4)6/h1-3H
InChIKeyPFHPKMPWBFJZEY-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 3-bromo-6-chloroimidazo[1,2-b]pyridazine?
The IUPAC name of 3-bromo-6-chloroimidazo[1,2-b]pyridazine (CID 12872323) is 3-bromo-6-chloroimidazo[1,2-b]pyridazine.
What is the SMILES notation for 3-bromo-6-chloroimidazo[1,2-b]pyridazine?
The canonical SMILES for 3-bromo-6-chloroimidazo[1,2-b]pyridazine is Clc1ccc2ncc(Br)n2n1.
What is the InChIKey of 3-bromo-6-chloroimidazo[1,2-b]pyridazine?
The InChIKey is PFHPKMPWBFJZEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3BrClN3/c7-4-3-9-6-2-1-5(8)10-11(4)6/h1-3H.
What are the key properties of 3-bromo-6-chloroimidazo[1,2-b]pyridazine?
3-bromo-6-chloroimidazo[1,2-b]pyridazine 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 3-bromo-6-chloroimidazo[1,2-b]pyridazine is sourced from PubChem (CID 12872323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).