3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine

C6H3BrClIN4 — CID 159283493

IUPAC3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine
SMILESNc1c(I)c(Cl)nn2c(Br)cnc12
InChIInChI=1S/C6H3BrClIN4/c7-2-1-11-6-4(10)3(9)5(8)12-13(2)6/h1H,10H2
InChIKeyKZFGJFBDESGSMT-UHFFFAOYSA-N
MW373.38 g/mol
LogP2.33
Rot. Bonds

About 3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine

3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine (PubChem CID 159283493) has the molecular formula C6H3BrClIN4 and a molecular weight of 373.38 g/mol. Its IUPAC name is 3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine.

Molecular Properties

Compound Name3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine
PubChem CID159283493
Molecular FormulaC6H3BrClIN4
Molecular Weight373.38 g/mol
Exact Mass371.83
IUPAC Name3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine
SMILESNc1c(I)c(Cl)nn2c(Br)cnc12
InChIInChI=1S/C6H3BrClIN4/c7-2-1-11-6-4(10)3(9)5(8)12-13(2)6/h1H,10H2
InChIKeyKZFGJFBDESGSMT-UHFFFAOYSA-N
XLogP2.33
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.38
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

3-Bromo-6-chloroimidazo(1,2-b)pyridazine
CID 12872323
6-Chloro-3-iodoimidazo[1,2-b]pyridazine
CID 53249897
8-Bromo-6-chloroimidazo(1,2-b)pyridazine
CID 46835269
3-Bromo-6-chloro-7-methylimidazo[1,2-b]pyridazine
CID 59380298
3-Bromo-6-chloroimidazo[1,2-b]pyridazin-8-amine
CID 132261433
6-Chloro-2-methylimidazo[1,2-b]pyridazin-8-amine
CID 168444628
6-Chloro-8-iodoimidazo[1,2-b]pyridazine
CID 129977721
6-chloro-3-isocyano-N-(2,2,2-trifluoroethyl)imidazo[1,2-b]pyridazin-8-amine
CID 59313847
7-bromo-3-iodo-N-(3,3,3-trifluoropropyl)imidazo[1,2-b]pyridazin-8-amine
CID 66691830
6-chloro-3-iodo-N-(3,3,3-trifluoropropyl)imidazo[1,2-b]pyridazin-8-amine
CID 87110486
6-chloro-3-iodo-N-(3,3,3-trifluoro-2-methylpropyl)imidazo[1,2-b]pyridazin-8-amine
CID 88585476
7-chloro-3-iodo-N-(3,3,3-trifluoropropyl)imidazo[1,2-b]pyridazin-8-amine
CID 123311536

Frequently Asked Questions

What is the IUPAC name of 3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine?
The IUPAC name of 3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine (CID 159283493) is 3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine.
What is the SMILES notation for 3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine?
The canonical SMILES for 3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine is Nc1c(I)c(Cl)nn2c(Br)cnc12.
What is the InChIKey of 3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine?
The InChIKey is KZFGJFBDESGSMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3BrClIN4/c7-2-1-11-6-4(10)3(9)5(8)12-13(2)6/h1H,10H2.
What are the key properties of 3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine?
3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine has a molecular weight of 373.38 g/mol, XLogP of 2.33, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-6-chloro-7-iodoimidazo[1,2-b]pyridazin-8-amine is sourced from PubChem (CID 159283493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).